data_2p01_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 2p01 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.719 0.295 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.485 ' C ' ' SD ' ' A' ' 22' ' ' MET . 73.2 ttp85 -67.77 -18.68 64.95 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.525 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.486 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -115.32 137.14 52.35 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.206 0.526 . . . . 0.0 111.102 -179.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.94 -36.49 84.55 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.474 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HA ' HE21 ' A' ' 27' ' ' GLN . 63.9 tttp -60.72 -47.35 86.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.106 0.479 . . . . 0.0 110.26 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.77 -38.25 87.35 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.486 ' ND2' ' O ' ' A' ' 22' ' ' MET . 57.7 m-80 -62.32 -40.69 97.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.972 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.552 HE21 ' HA ' ' A' ' 24' ' ' LYS . 34.3 mt-30 -60.84 -45.7 93.48 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.722 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.22 -41.03 96.15 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.032 0.444 . . . . 0.0 109.973 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -57.96 -44.71 87.2 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.121 0.486 . . . . 0.0 109.787 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -60.48 -37.46 81.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.577 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 73.5 mmtt -61.38 -42.53 98.87 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.255 0.55 . . . . 0.0 109.678 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.72 -37.31 86.05 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.149 -0.621 . . . . 0.0 110.113 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -61.15 -46.37 90.82 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.254 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.577 ' HG2' ' O ' ' A' ' 31' ' ' LYS . 53.6 ptt85 -66.19 -35.1 79.57 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.119 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.36 -38.63 91.91 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.051 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.77 110.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.707 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 mt -132.69 154.59 81.54 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.741 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_exo -42.54 154.3 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.415 2.077 . . . . 0.0 112.487 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.12 -46.86 22.87 Favored 'Trans proline' 0 N--CA 1.497 1.73 0 C-N-CA 122.615 2.21 . . . . 0.0 112.51 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.472 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 62.2 t -64.14 -46.46 93.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.726 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -64.06 -41.86 97.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.133 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.97 -44.2 97.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.61 90.47 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.71 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.472 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 1.7 mp0 -67.73 -46.94 70.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.84 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.16 -46.92 84.91 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.023 0.44 . . . . 0.0 110.489 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -59.27 -42.32 90.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.05 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.566 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.62 -47.64 84.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.939 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -56.01 -47.13 78.34 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.68 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.32 -40.86 87.61 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -59.4 -39.34 83.1 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.842 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 47' ' ' ALA . 40.6 mm -62.33 -43.7 98.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -55.5 -44.71 76.84 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.267 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -60.08 -46.53 89.28 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.088 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -60.66 -44.48 96.38 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.364 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -61.07 -37.45 82.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.311 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -60.44 -45.1 94.89 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.26 -42.01 97.9 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.213 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.54 94.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.014 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -58.6 -43.53 89.59 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.759 0.314 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -60.2 -46.57 89.26 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.012 0.434 . . . . 0.0 110.044 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.79 -39.57 94.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.786 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.6 mt -61.57 -43.17 99.36 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.27 -37.02 85.99 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.907 179.879 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.567 0 N-CA-C 110.681 -0.967 . . . . 0.0 110.681 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -64.05 -34.75 78.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.37 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.1 -50.1 75.35 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.088 0.47 . . . . 0.0 109.857 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -61.4 -41.89 97.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.188 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.23 89.85 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.382 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -62.5 -42.74 99.71 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.642 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.16 -43.45 98.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.522 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.9 -44.53 98.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 121.094 0.473 . . . . 0.0 109.966 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -59.87 -41.12 90.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.098 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.78 -39.34 94.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.39 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.43 -49.14 78.95 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.39 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -64.31 -39.02 93.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.512 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.18 -46.21 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.835 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.44 HD12 HG22 ' A' ' 84' ' ' ILE . 96.7 mt -61.53 -47.66 92.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.183 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.3 -39.63 92.74 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.648 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.49 93.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.545 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.66 -44.54 96.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.693 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -69.49 -26.0 64.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.32 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.03 28.07 71.05 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 120.898 0.38 . . . . 0.0 110.68 179.899 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 98.3 mt . . . . . 0 C--O 1.233 0.213 0 CA-C-O 120.976 0.417 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.5 mt-10 -62.13 -30.39 71.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.579 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.75 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.1 mttt -62.93 -50.45 70.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.747 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 32.5 mt -68.08 -43.83 77.63 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.461 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 8.0 t-105 -60.41 -51.3 70.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 -179.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.524 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -70.08 -37.55 75.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.026 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.75 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.5 OUTLIER -55.45 -50.87 68.71 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.463 -178.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.586 ' C ' ' HB2' ' A' ' 130' ' ' PHE . . . -72.5 -46.93 52.4 Favored 'General case' 0 C--O 1.246 0.886 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.288 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -47.15 -33.91 5.64 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.46 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -106.15 -35.43 7.22 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.986 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.59 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 36.9 m -50.72 -24.84 3.69 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.279 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -153.89 -95.8 0.12 Allowed Glycine 0 CA--C 1.525 0.703 0 C-N-CA 119.686 -1.245 . . . . 0.0 111.824 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.738 ' O ' ' N ' ' A' ' 131' ' ' SER . 68.8 mttm -150.93 25.27 0.74 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.372 0.605 . . . . 0.0 110.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.586 ' HB2' ' C ' ' A' ' 124' ' ' ALA . 21.9 m-85 -49.72 60.82 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.186 -1.37 . . . . 0.0 111.14 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.738 ' N ' ' O ' ' A' ' 129' ' ' LYS . 30.3 p -70.1 146.44 50.89 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.446 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . -37.03 -18.56 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.178 -173.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.632 ' N ' ' O ' ' A' ' 131' ' ' SER . 48.8 mt-10 -74.31 -46.14 42.9 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 118.927 -1.109 . . . . 0.0 108.497 176.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' A' ' 131' ' ' SER . 80.4 mm-40 -75.62 -42.36 51.85 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.354 178.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.438 ' CD1' ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -60.07 -37.47 79.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.446 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 54.5 m-20 -61.92 -43.94 97.8 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.362 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -58.92 -45.16 91.05 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 119.881 -0.727 . . . . 0.0 109.9 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.442 ' O ' ' CG ' ' A' ' 141' ' ' GLU . 4.5 mm? -61.01 -40.37 93.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 178.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.559 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -65.12 -31.53 72.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 176.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.567 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 84.5 mmt-85 -57.6 -48.51 79.19 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.245 -0.982 . . . . 0.0 108.358 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . 0.442 ' CG ' ' O ' ' A' ' 138' ' ' LEU . 9.4 pt-20 -71.46 -34.16 69.98 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.964 -0.694 . . . . 0.0 111.912 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.2 m-85 -56.15 -58.78 6.48 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.184 0.516 . . . . 0.0 110.242 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.41 -37.59 86.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.214 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 67.4 m170 -51.51 -42.7 61.9 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 119.677 -0.809 . . . . 0.0 109.388 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.88 -41.67 91.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.396 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -61.29 -44.15 97.7 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.31 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -68.05 -49.19 62.9 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -61.37 -42.91 99.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.606 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.06 -45.09 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.542 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.545 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.4 m170 -61.12 -35.96 78.45 Favored 'General case' 0 C--O 1.215 -0.742 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.294 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -65.21 -46.68 79.69 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.191 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.416 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 42.1 m-85 -65.69 -44.02 87.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.837 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -70.44 -45.2 66.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.667 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.545 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 75.9 t -63.12 -45.96 97.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.905 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 73.4 mt . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.42 179.21 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 . . . . . 0 CA--C 1.522 -0.123 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.477 ' HA ' ' HZ1' ' A' ' 193' ' ' LYS . 8.5 mt -61.97 -47.85 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.592 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.465 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.7 mtpt -68.59 -40.88 80.32 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.438 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.412 ' O ' ' OG ' ' A' ' 196' ' ' SER . 80.2 tt0 -68.76 -44.95 72.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.883 -178.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.477 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 1.8 pttm -71.57 -44.46 64.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.233 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.525 ' HG ' ' N ' ' A' ' 195' ' ' ARG . 0.4 OUTLIER -69.36 -42.82 74.72 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.32 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.525 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.99 -37.56 88.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.413 ' N ' ' HD2' ' A' ' 195' ' ' ARG . 69.3 m -62.18 -44.32 96.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -65.38 -43.71 94.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.983 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -63.06 -42.47 99.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.822 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -66.04 -33.12 75.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.334 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.95 -49.51 74.83 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 23.0 mt -63.49 -40.46 97.15 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.961 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.8 -37.41 84.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -42.83 99.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.238 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.51 -41.48 97.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -64.52 -42.94 95.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.803 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.711 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -65.99 -40.29 91.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.565 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.521 ' O ' ' N ' ' A' ' 211' ' ' GLY . 22.0 t -63.65 -46.82 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.86 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.8 p -72.07 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.058 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -100.5 -14.76 18.12 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.318 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.711 ' N ' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -130.75 -39.53 1.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.045 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.503 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 219' ' ' GLU . 73.8 tt0 . . . . . 0 CA--C 1.531 0.228 0 CA-C-O 120.678 0.275 . . . . 0.0 110.72 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -61.33 139.86 94.66 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.521 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.425 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 68.9 Cg_endo -76.88 14.63 1.25 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.582 2.188 . . . . 0.0 111.919 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -105.94 -62.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.319 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.521 HG11 ' H ' ' A' ' 224' ' ' ILE . 0.5 OUTLIER -61.11 -55.31 25.48 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 CA-C-O 121.073 0.464 . . . . 0.0 111.619 -179.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.521 ' H ' HG11 ' A' ' 223' ' ' VAL . 2.9 mm -62.75 -41.5 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 47.8 t0 -62.58 -37.7 87.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.95 0.405 . . . . 0.0 109.938 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 6.0 tp -60.19 -43.49 95.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 46.2 m0 -60.26 -38.63 84.11 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.054 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . 0.511 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 45.1 t0 -61.64 -33.83 74.63 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 178.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.647 ' O ' ' N ' ' A' ' 232' ' ' SER . 38.6 mt -64.32 -40.08 95.19 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.071 0.463 . . . . 0.0 110.695 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.521 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -24.58 -51.77 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.092 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.511 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 2.3 pt20 -58.27 -44.81 88.57 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.232 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.647 ' N ' ' O ' ' A' ' 229' ' ' LEU . 9.9 m -79.97 -7.54 58.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.377 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -81.91 10.73 5.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.928 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.6 m120 67.56 91.28 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.31 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 79.7 mt -129.73 166.34 20.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.701 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.0 p -73.46 161.56 30.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.722 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -63.99 -46.28 85.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.57 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -62.68 -46.71 86.92 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.993 0.425 . . . . 0.0 110.524 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -67.44 -37.96 83.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.557 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -63.07 -42.58 99.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.731 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -64.77 -52.83 54.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.522 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.59 -37.77 76.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.468 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -66.7 -44.14 82.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.853 178.789 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -57.3 -47.93 80.22 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.902 0.382 . . . . 0.0 110.264 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.96 -38.81 83.22 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.814 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -60.02 -49.6 77.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.944 0.402 . . . . 0.0 110.492 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.5 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 4.0 mm? -63.78 -40.33 96.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.976 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.5 -44.25 84.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.923 0.392 . . . . 0.0 110.037 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -67.01 -41.16 87.17 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.714 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -59.4 -48.89 79.9 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 120.739 0.304 . . . . 0.0 111.282 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 12.4 pt-20 -65.1 -37.65 88.17 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.76 -40.08 88.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.743 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -62.85 -45.39 92.78 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.428 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -65.05 -40.3 88.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.079 -0.649 . . . . 0.0 109.832 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.81 -44.56 96.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -61.82 -42.41 98.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.102 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -56.11 -45.49 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.24 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . 0.401 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 53.8 t-20 -59.13 -41.95 89.47 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.362 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -59.02 -45.52 90.5 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.371 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -62.18 -38.26 88.41 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.148 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.503 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 61.4 mm-40 -59.7 -42.28 92.64 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.049 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -62.07 -47.74 83.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.419 -0.513 . . . . 0.0 109.848 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -65.24 -34.09 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.111 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.43 -42.13 99.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.89 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -64.19 -47.6 79.13 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.05 -43.42 99.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.1 -38.17 82.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.975 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.82 -44.29 97.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.955 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . 0.543 ' OE2' ' NE2' ' A' ' 273' ' ' HIS . 17.3 tp10 -59.83 -44.84 93.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.136 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.09 -39.43 89.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 28.3 tp -60.3 -44.75 95.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.072 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . 0.425 ' NH2' ' OE1' ' A' ' 269' ' ' GLU . 86.6 mtm180 -61.15 -42.07 97.89 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.095 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . 0.543 ' NE2' ' OE2' ' A' ' 269' ' ' GLU . 18.1 m170 -67.85 -43.09 80.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.214 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.64 84.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.886 0.374 . . . . 0.0 110.939 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -64.3 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 7.8 t -61.95 -20.44 63.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.78 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.402 HG13 ' H ' ' A' ' 279' ' ' ASP . 91.5 t -61.3 -46.26 96.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.884 0.373 . . . . 0.0 110.413 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.72 58.04 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . 0.402 ' H ' HG13 ' A' ' 277' ' ' VAL . 91.1 m-20 -68.07 -24.06 65.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.602 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 83.78 5.74 87.73 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . 0.682 ' C ' ' H ' ' A' ' 283' ' ' VAL . 75.0 mm-40 -82.91 156.92 23.28 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 110.026 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 61.2 -17.8 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.732 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . 0.682 ' H ' ' C ' ' A' ' 281' ' ' GLU . 73.7 t -63.25 -47.4 92.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.66 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 5.9 t -64.3 -46.22 84.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.485 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -62.96 -46.25 88.62 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.927 0.394 . . . . 0.0 110.79 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 m -61.58 -42.09 98.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.529 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -64.32 -39.03 93.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.38 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -60.71 -55.3 34.84 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 8.1 mmtp -64.02 -32.8 74.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.375 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . 0.572 ' CE1' ' OE2' ' A' ' 294' ' ' GLU . 19.9 t-80 -57.82 -49.86 75.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.351 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.27 -39.12 82.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.746 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 4.4 tp -61.5 -47.13 87.02 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.341 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 1.1 mt -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.058 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.572 ' OE2' ' CE1' ' A' ' 290' ' ' HIS . 92.1 mt-10 -64.2 -36.14 83.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.12 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.92 89.42 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . 0.521 ' NH1' ' OE1' ' A' ' 299' ' ' GLU . 14.2 tpp180 -62.81 -42.7 99.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.682 0.277 . . . . 0.0 110.744 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.524 ' HG1' ' H ' ' A' ' 298' ' ' LYS . 23.4 p -59.06 -50.04 75.61 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.427 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . 0.524 ' H ' ' HG1' ' A' ' 297' ' ' THR . 52.6 tttp -63.07 -43.2 99.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.529 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . 0.521 ' OE1' ' NH1' ' A' ' 296' ' ' ARG . 83.6 tt0 -62.0 -40.54 96.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.294 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.61 95.64 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.267 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.65 -41.59 97.46 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . 0.449 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 70.1 t80 -62.15 -45.54 92.96 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.53 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 303' ' ' THR . . . . . 0.433 HG21 ' HD1' ' A' ' 307' ' ' HIS . 8.9 m -60.44 -43.4 96.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.447 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.97 -43.25 91.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 52.0 tttp -56.32 -50.41 71.55 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.342 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . 0.449 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 30.9 mtpt -62.78 -42.35 99.66 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.49 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.433 ' HD1' HG21 ' A' ' 303' ' ' THR . 6.6 m80 -61.78 -37.97 86.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . 0.487 ' O ' ' OG ' ' A' ' 312' ' ' SER . 9.4 mt -61.02 -44.61 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.277 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -68.96 -45.69 70.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.068 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -62.73 -52.07 64.68 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.536 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.04 -38.7 91.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.504 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 312' ' ' SER . . . . . 0.487 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 39.0 m -58.38 -44.61 88.99 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.381 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -73.06 -47.28 24.83 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.135 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -63.6 -45.44 90.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.743 0.306 . . . . 0.0 110.521 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . 0.551 ' O ' ' C ' ' A' ' 316' ' ' SER . 2.5 mm -70.48 -27.02 29.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.576 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.551 ' C ' ' O ' ' A' ' 315' ' ' ILE . 23.1 t -37.15 -48.62 0.84 Allowed 'General case' 0 CA--C 1.486 -1.517 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 . . . . . 0 N--CA 1.428 -1.557 0 C-N-CA 116.297 -2.161 . . . . 0.0 113.249 173.39 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.483 ' H ' ' CG ' ' A' ' 26' ' ' ASN . 33.5 m-85 . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.74 0.305 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.19 -19.1 61.79 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.826 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.472 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 99.2 mmm -135.1 148.0 49.69 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.242 0.544 . . . . 0.0 110.916 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -64.36 -37.16 86.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.486 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.7 -48.59 80.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.117 0.484 . . . . 0.0 110.45 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.16 -38.32 86.03 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.496 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.483 ' CG ' ' H ' ' A' ' 20' ' ' PHE . 58.1 m-80 -63.27 -39.94 95.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.196 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -61.65 -43.9 97.98 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.282 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.452 ' N ' HD21 ' A' ' 28' ' ' LEU . 2.3 mm? -62.6 -43.17 99.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.514 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 48.0 t-105 -63.01 -50.63 69.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.469 0.652 . . . . 0.0 110.346 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -56.91 -39.05 73.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.846 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -61.07 -44.37 97.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.024 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.82 88.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.806 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.622 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 76.1 mt-30 -61.14 -38.24 85.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.946 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 mmm-85 -64.12 -39.27 93.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.545 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 88.8 mt -66.04 -32.54 74.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.397 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.622 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 32.6 m170 65.86 113.87 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.752 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.2 mt -138.38 154.49 73.68 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.753 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -42.01 154.6 0.1 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.454 2.102 . . . . 0.0 112.321 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -69.41 -40.35 5.99 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.548 2.165 . . . . 0.0 112.454 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 63.1 t -63.21 -48.92 85.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.578 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -66.31 -39.42 89.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.447 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.26 -41.84 99.08 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.552 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.44 78.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.52 -42.63 87.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.9 tp -62.45 -47.46 83.94 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.152 0.501 . . . . 0.0 110.748 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.03 -41.57 96.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.273 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.554 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.16 -48.37 81.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.727 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -54.11 -48.5 70.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.865 0.364 . . . . 0.0 110.251 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.82 -40.07 83.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -59.94 -40.01 87.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.3 mm -62.53 -42.9 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.81 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.588 HE22 HD23 ' A' ' 81' ' ' LEU . 48.0 tt0 -59.67 -45.49 91.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.351 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -57.4 -48.0 80.22 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.346 0.593 . . . . 0.0 110.114 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -59.57 -43.97 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.311 0.577 . . . . 0.0 110.267 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -60.67 -40.16 91.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -58.29 -46.03 86.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.194 0.521 . . . . 0.0 109.848 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.87 -42.63 94.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.998 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.87 -45.2 95.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.549 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 82.2 t90 -56.09 -42.53 76.89 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.283 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.3 -45.95 91.58 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.205 0.526 . . . . 0.0 109.715 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -57.1 -44.63 83.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.11 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.3 mp -62.37 -40.11 95.36 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.021 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -56.46 -44.67 80.77 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 27.0 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.254 179.19 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.806 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -59.69 -39.1 83.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 110.201 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -56.93 -64.26 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.079 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -48.0 -40.38 22.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.216 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.33 86.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.225 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.7 ttt85 -61.34 -41.1 96.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.447 HD13 ' N ' ' A' ' 77' ' ' LEU . 11.0 mp -61.89 -44.15 97.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.146 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.41 -45.77 92.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.293 0.568 . . . . 0.0 109.97 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.422 ' O ' ' CG2' ' A' ' 83' ' ' VAL . 40.7 mmm-85 -61.79 -38.9 89.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.962 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.409 ' O ' HG13 ' A' ' 84' ' ' ILE . 38.0 t30 -64.02 -40.48 96.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.185 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.588 HD23 HE22 ' A' ' 52' ' ' GLN . 0.2 OUTLIER -59.64 -49.86 76.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.311 0.577 . . . . 0.0 109.97 -179.392 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -66.17 -37.51 85.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.549 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.462 ' CG1' ' HZ3' ' A' ' 87' ' ' LYS . 54.4 t -62.52 -46.57 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.653 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 80' ' ' ASN . 80.4 mt -61.35 -46.95 95.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.391 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.6 mt -65.31 -39.35 92.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.911 0.386 . . . . 0.0 110.555 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.34 -48.21 82.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.866 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.462 ' HZ3' ' CG1' ' A' ' 83' ' ' VAL . 47.3 mttp -62.73 -45.33 93.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.776 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -64.35 -30.21 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.376 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.31 9.67 83.41 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--N 1.333 -0.144 0 CA-C-O 120.811 0.338 . . . . 0.0 110.349 179.994 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 C--O 1.236 0.384 0 CA-C-O 121.081 0.467 . . . . 0.0 110.439 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.609 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.0 mt-10 -55.89 -24.86 39.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.428 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.55 -49.87 74.93 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.78 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.488 HD22 ' CZ ' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -71.42 -46.68 59.5 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.146 0.498 . . . . 0.0 111.782 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 19.3 t-105 -55.89 -46.06 78.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.506 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.609 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.3 m-70 -71.19 -34.07 70.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.539 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.577 ' O ' ' OG ' ' A' ' 127' ' ' SER . 10.3 tptt -55.54 -51.38 67.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.079 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -75.34 -47.15 29.05 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.974 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -50.77 -39.55 52.69 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.747 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.3 m -94.1 -41.72 9.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.875 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.577 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 15.8 m -44.6 -27.11 0.44 Allowed 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -156.54 -97.08 0.13 Allowed Glycine 0 N--CA 1.462 0.373 0 C-N-CA 119.611 -1.281 . . . . 0.0 111.128 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.679 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.6 mttt -157.46 20.76 0.29 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.579 ' CE1' ' OE1' ' A' ' 134' ' ' GLU . 3.2 m-85 -60.12 50.05 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.671 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.679 ' N ' ' O ' ' A' ' 129' ' ' LYS . 0.1 OUTLIER -107.89 114.94 29.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.983 0.42 . . . . 0.0 111.705 -179.285 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 136' ' ' ASP . . . 120.51 -98.06 0.67 Allowed Glycine 0 CA--C 1.524 0.641 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.136 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.563 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 54.2 mp0 -78.79 -40.03 34.21 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.2 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.579 ' OE1' ' CE1' ' A' ' 130' ' ' PHE . 44.2 mt-10 -64.15 -43.55 94.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.563 0.697 . . . . 0.0 110.008 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 130' ' ' PHE . 1.6 mt -68.77 -35.62 77.29 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.275 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.517 ' CG ' ' N ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -62.36 -49.03 77.18 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.367 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 136' ' ' ASP . 18.6 ptpt -59.96 -38.52 82.73 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.465 ' N ' ' HG3' ' A' ' 137' ' ' LYS . 6.6 mt -59.84 -42.61 94.0 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.24 -39.19 78.64 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.583 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 81.9 mtp180 -54.45 -42.95 71.21 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.125 -1.03 . . . . 0.0 108.397 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -72.2 -39.4 68.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.728 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.488 ' CZ ' HD22 ' A' ' 120' ' ' LEU . 0.2 OUTLIER -59.76 -58.95 6.34 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.722 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.1 -41.01 97.76 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.583 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 36.4 m170 -57.62 -41.4 81.25 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.534 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.506 ' O ' ' CG2' ' A' ' 149' ' ' VAL . 10.5 m-70 -64.33 -39.7 94.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.627 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -59.55 -47.64 84.75 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.488 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.556 ' HA ' ' HD1' ' A' ' 150' ' ' HIS . 99.2 mt-10 -68.43 -53.48 23.31 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.631 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.56 -40.93 96.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.997 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . 0.506 ' CG2' ' O ' ' A' ' 145' ' ' HIS . 41.3 t -62.59 -44.17 99.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.173 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.689 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 0.8 OUTLIER -65.58 -38.96 91.02 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.576 -0.85 . . . . 0.0 109.312 -178.966 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.68 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 97.1 mt-10 -58.87 -45.94 88.98 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.125 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.493 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 2.5 m-85 -62.55 -43.6 98.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.654 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.99 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.049 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 12.8 t -60.24 -46.4 94.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 0.0 110.643 179.79 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 . . . . . 0 CA--C 1.515 -0.389 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.495 ' N ' HD12 ' A' ' 190' ' ' LEU . 4.6 mp -62.34 -41.89 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.033 0.444 . . . . 0.0 110.51 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -68.78 -33.78 74.46 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.846 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.588 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -67.8 -46.07 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.142 0.496 . . . . 0.0 111.685 -179.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.539 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 pttt -72.03 -44.67 63.02 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.536 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.01 -41.3 97.51 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.558 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 192' ' ' GLU . 0.4 OUTLIER -66.04 -35.6 80.98 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.539 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 55.6 p -59.93 -39.68 86.33 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 70.2 mt -63.84 -43.59 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.26 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -62.25 -41.05 98.09 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.48 0.657 . . . . 0.0 109.303 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.554 ' NE2' ' NE ' ' A' ' 195' ' ' ARG . 86.1 mt-30 -61.95 -39.26 91.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.091 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.74 -39.63 95.54 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.72 -42.59 99.73 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.75 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 0.5 OUTLIER -63.1 -37.17 86.13 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.099 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.579 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 1.9 tmm_? -63.26 -41.75 99.08 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.325 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.83 -40.55 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.157 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.86 -43.68 98.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.511 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.682 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.1 mtt180 -63.7 -37.01 85.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.186 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.536 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 45.2 t -63.6 -45.33 97.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.093 0.473 . . . . 0.0 110.134 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -67.0 -29.38 69.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.63 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -94.32 -45.41 7.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.531 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 206' ' ' ARG . 46.1 tt0 -98.83 -31.4 11.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.141 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.536 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 . . . . . 0 N--CA 1.469 0.48 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.87 158.24 54.53 Favored Pre-proline 0 N--CA 1.464 0.24 0 C-N-CA 120.776 -0.369 . . . . 0.0 110.556 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -54.65 128.38 30.06 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.391 2.061 . . . . 0.0 112.087 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.51 ' HE ' HG21 ' A' ' 223' ' ' VAL . 62.7 ttp180 179.05 -95.88 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.519 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.51 HG21 ' HE ' ' A' ' 222' ' ' ARG . 5.0 t -61.53 -51.38 73.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-O 121.548 0.69 . . . . 0.0 110.585 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.4 HG13 ' CZ3' ' A' ' 227' ' ' TRP . 1.7 mt -66.05 -28.41 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.749 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -63.79 -40.7 97.29 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 13.7 mt -62.31 -40.94 97.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.026 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . 0.547 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 20.6 m0 -59.52 -38.6 81.39 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.095 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . 0.492 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 46.3 m-20 -63.5 -38.18 90.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.567 ' O ' ' N ' ' A' ' 232' ' ' SER . 89.1 mt -62.39 -41.55 98.74 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.129 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.475 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -32.75 -34.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.074 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.552 ' CG ' ' N ' ' A' ' 232' ' ' SER . 7.6 pt20 -66.26 -46.24 77.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.728 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.567 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.0 m -89.1 -6.75 56.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.362 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -72.99 9.54 1.15 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . 0.453 ' H ' ' C ' ' A' ' 232' ' ' SER . 58.8 t30 69.19 89.84 0.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.165 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 79.6 mt -132.03 -173.25 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.687 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 62.1 p -84.38 164.77 18.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.6 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . 0.482 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 21.7 p-10 -73.81 -46.2 46.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.61 -46.58 89.21 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.171 0.51 . . . . 0.0 110.469 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -61.22 -35.82 78.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.707 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 2.8 mt -64.56 -39.76 94.33 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.69 -52.55 62.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.25 95.33 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.583 -0.447 . . . . 0.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.46 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.2 OUTLIER -70.02 -32.88 71.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.304 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -62.56 -55.75 24.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.125 0.488 . . . . 0.0 110.31 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -65.51 -37.46 86.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.541 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -56.76 -50.21 72.95 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.218 0.532 . . . . 0.0 110.377 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.514 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.0 mm? -63.96 -39.54 94.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.741 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -54.76 -47.27 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.146 0.498 . . . . 0.0 110.475 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -67.32 -39.39 85.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.614 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -59.69 -49.77 76.46 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.018 0.437 . . . . 0.0 111.364 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.0 pt-20 -63.72 -37.34 86.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.932 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.86 88.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -61.42 -51.47 68.62 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.093 0.473 . . . . 0.0 111.006 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -66.31 -35.35 74.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.201 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.72 -44.54 95.94 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.324 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.2 -43.96 97.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.02 -44.36 82.79 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.093 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -60.91 -40.49 93.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.45 -48.59 81.08 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 110.444 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -62.81 -35.66 80.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.588 HE21 ' CG2' ' A' ' 297' ' ' THR . 76.6 mm-40 -60.88 -44.48 97.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.183 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.98 -48.3 80.95 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.8 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -64.16 -34.1 77.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.866 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.25 -41.97 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.856 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.16 -45.5 84.68 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.554 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.2 mt -62.63 -43.4 98.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.118 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.36 88.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.209 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -60.92 -46.02 92.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.12 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.22 -45.99 91.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.136 0.493 . . . . 0.0 110.279 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.75 -40.14 94.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.447 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 5.0 tt -59.17 -43.69 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.095 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -62.31 -41.08 98.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.269 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -66.81 -44.22 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.42 -36.92 85.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.627 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.03 -26.08 68.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 35.9 t -60.58 -39.83 89.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.376 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.42 -43.48 94.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.275 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.71 8.93 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . 0.406 ' C ' ' H ' ' A' ' 281' ' ' GLU . 47.4 m-20 -63.8 -42.88 97.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.732 0.301 . . . . 0.0 110.654 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 70.26 -3.85 9.96 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . 0.406 ' H ' ' C ' ' A' ' 279' ' ' ASP . 47.8 tp10 -96.98 -56.58 2.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 110.472 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -80.88 -15.95 54.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.746 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.51 -47.13 93.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.655 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 43.8 t -63.87 -43.99 94.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -59.73 -47.49 85.43 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.589 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 15.2 t -63.03 -45.87 90.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -63.96 -38.82 92.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.669 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.97 -57.85 11.26 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.155 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -64.32 -35.58 81.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.12 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -51.41 -52.95 41.6 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.268 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.25 -36.16 79.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.663 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.74 -52.03 66.83 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.374 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 14.8 tp -62.74 -42.85 99.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.451 0.643 . . . . 0.0 109.923 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.63 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.6 tt0 -64.7 -33.24 75.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.876 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -65.08 -47.58 80.29 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . 0.535 ' HG3' ' N ' ' A' ' 297' ' ' THR . 0.0 OUTLIER -62.36 -36.98 83.93 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.63 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 16.1 p -61.51 -44.11 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.43 -43.72 98.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.215 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.66 -37.7 88.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.122 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -44.46 96.23 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.1 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.31 99.57 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -60.22 -44.56 95.08 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.144 0.497 . . . . 0.0 110.365 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.0 m -61.04 -42.76 99.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.381 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.1 -43.16 88.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.031 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -59.91 -49.75 76.47 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.203 0.525 . . . . 0.0 110.464 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -63.3 -42.42 99.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.55 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.35 -37.5 87.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.898 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . 0.447 ' O ' ' CB ' ' A' ' 312' ' ' SER . 12.2 mt -61.52 -42.45 98.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.489 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -65.78 -60.75 2.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.96 0.41 . . . . 0.0 111.374 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -60.63 -48.34 82.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.392 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 307' ' ' HIS . 9.1 tp -61.72 -40.73 96.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.563 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 312' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 11.4 t -59.2 -44.69 92.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.346 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.35 -38.02 95.75 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -63.15 -45.05 93.7 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.6 mm -71.84 -25.52 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.88 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' A' ' 317' ' ' ARG . 28.0 p -44.03 -61.31 1.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.498 ' N ' ' OG ' ' A' ' 316' ' ' SER . 7.3 ptt-85 . . . . . 0 C--N 1.331 -0.224 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.461 0.107 0 CA-C-O 120.661 0.267 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -87.64 -12.2 46.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.512 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 78.5 mtp -119.42 138.5 53.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.109 0.48 . . . . 0.0 111.04 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -64.44 -36.53 84.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.44 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.94 -48.31 82.23 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.545 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.0 mp -61.73 -38.36 87.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.477 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 55.5 t-20 -63.18 -39.24 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.094 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.8 tp60 -60.25 -46.55 89.41 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.348 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.72 -42.47 98.99 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.352 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -61.59 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.176 0.512 . . . . 0.0 110.533 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -58.46 -44.03 89.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.128 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.21 -41.59 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.367 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.0 88.48 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.075 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -62.06 -39.61 92.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.853 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -61.7 -41.49 97.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.347 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.16 -39.63 95.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.91 107.96 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.821 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -125.08 154.6 71.52 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.678 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -42.93 154.88 0.13 Allowed 'Trans proline' 0 N--CA 1.492 1.382 0 C-N-CA 122.507 2.138 . . . . 0.0 112.372 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.01 -43.81 53.16 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.585 2.19 . . . . 0.0 112.209 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.424 HG21 ' H ' ' A' ' 41' ' ' ARG . 2.8 m -67.36 -46.06 84.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.996 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.424 ' H ' HG21 ' A' ' 40' ' ' VAL . 21.6 mmt85 -65.37 -42.1 93.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.805 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 tp -63.92 -43.99 94.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.593 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.79 -42.76 90.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.675 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -66.96 -46.24 75.27 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.3 tp -62.94 -45.7 91.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.359 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -59.5 -41.96 91.09 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.983 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.422 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.51 -47.36 85.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.657 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -57.0 -47.21 81.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.365 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.4 mt -57.06 -41.99 79.73 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.224 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.63 -38.79 85.96 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.228 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.422 HG12 ' O ' ' A' ' 47' ' ' ALA . 4.9 mm -61.34 -43.32 96.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.529 ' NE2' HD21 ' A' ' 80' ' ' ASN . 49.1 mm-40 -58.16 -47.66 82.68 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.622 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.26 -47.4 81.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.154 0.502 . . . . 0.0 110.237 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.451 HH11 ' HD3' ' A' ' 54' ' ' ARG . 39.3 mtp-105 -62.0 -41.97 98.63 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.611 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -63.59 -36.81 85.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.413 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -60.66 -49.19 78.53 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.012 0.434 . . . . 0.0 109.999 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.83 -41.18 97.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.259 -0.577 . . . . 0.0 110.089 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.56 96.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.7 t90 -59.7 -42.59 93.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.729 0.299 . . . . 0.0 110.45 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -60.49 -45.61 93.12 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.771 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -60.72 -41.81 96.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.839 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.421 HD13 ' HZ3' ' A' ' 73' ' ' LYS . 84.4 mt -61.05 -41.23 96.21 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.8 -38.91 86.97 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.3 tt . . . . . 0 C--N 1.329 -0.289 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.963 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.654 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.44 -37.75 87.11 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.451 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HZ3' HD13 ' A' ' 62' ' ' LEU . 87.4 mttt -54.4 -53.91 47.75 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.003 0.43 . . . . 0.0 110.122 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -60.92 -39.13 88.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.93 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.59 -39.88 95.13 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.475 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.527 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 83.8 mt -63.09 -44.97 94.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.211 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.7 -46.34 89.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-O 121.152 0.501 . . . . 0.0 110.375 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -60.09 -43.8 95.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.977 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.529 HD21 ' NE2' ' A' ' 52' ' ' GLN . 34.5 t30 -61.73 -40.09 93.86 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.448 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.4 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.73 -48.73 80.5 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.717 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -65.17 -38.17 89.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.507 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.93 -46.89 95.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.493 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.446 HG22 HD13 ' A' ' 84' ' ' ILE . 97.1 mt -60.19 -51.07 77.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.467 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.72 -41.07 96.24 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.888 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.96 92.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.523 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -62.63 -47.76 82.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.992 0.425 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -72.78 -22.18 60.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.126 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.45 25.13 73.48 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.7 mt . . . . . 0 C--N 1.331 -0.206 0 CA-C-O 120.886 0.374 . . . . 0.0 110.537 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.1 mt . . . . . 0 C--O 1.235 0.322 0 CA-C-O 121.087 0.47 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.597 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.6 mt-10 -57.97 -25.96 61.69 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.599 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 70.1 mmtt -61.53 -54.75 39.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.703 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.61 -43.98 79.15 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 13.4 t-105 -58.84 -48.91 79.68 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.478 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.597 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.7 m-70 -70.04 -33.38 71.9 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.733 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.534 ' O ' ' OG ' ' A' ' 127' ' ' SER . 11.6 tptt -56.86 -51.27 69.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.718 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.91 -47.28 59.97 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 119.596 -0.841 . . . . 0.0 111.086 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -53.71 -51.48 63.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.918 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.2 m -75.25 -43.27 52.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.73 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 9.6 m -44.48 -30.9 0.95 Allowed 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -160.54 -96.55 0.11 Allowed Glycine 0 CA--C 1.517 0.166 0 C-N-CA 119.48 -1.343 . . . . 0.0 111.526 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.693 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.6 mttt -153.63 21.43 0.53 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -59.14 50.56 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.511 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.693 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.8 p -109.17 135.4 50.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.348 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 96.43 -96.62 1.93 Allowed Glycine 0 CA--C 1.526 0.728 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.908 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.546 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 56.6 mp0 -72.71 -43.79 62.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.342 . . . . 0.0 111.166 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.514 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 46.9 mp0 -63.97 -51.77 62.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.023 0.439 . . . . 0.0 110.404 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.8 mt -61.56 -39.69 92.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.673 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -60.32 -42.81 96.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.975 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -62.04 -41.4 98.07 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 110.094 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.417 ' N ' HD13 ' A' ' 138' ' ' LEU . 9.4 mp -59.81 -41.81 92.07 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -66.54 -35.44 80.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 176.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.421 ' O ' ' CD2' ' A' ' 144' ' ' HIS . 69.9 mtp180 -55.31 -43.27 74.7 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.233 178.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -71.18 -41.19 70.65 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.824 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -60.46 -54.93 39.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.793 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.02 -39.59 90.33 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.937 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.421 ' CD2' ' O ' ' A' ' 140' ' ' ARG . 4.1 m170 -56.16 -42.68 77.41 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.401 ' HD1' HG22 ' A' ' 197' ' ' ILE . 5.7 m-70 -63.05 -40.78 98.73 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.425 178.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -61.49 -42.93 99.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.884 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.704 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 98.7 mt-10 -67.97 -46.25 71.9 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 111.555 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -70.83 -43.93 67.55 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.55 -50.62 77.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.704 ' CD2' ' O ' ' A' ' 147' ' ' GLU . 0.2 OUTLIER -70.08 -23.87 63.14 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.59 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.686 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 19.8 mm-40 -68.18 -45.0 74.64 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.417 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 16.8 m-85 -62.78 -45.35 93.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -65.5 -41.03 93.66 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.583 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.429 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 35.2 t -61.94 -46.33 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.0 0.429 . . . . 0.0 110.286 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 81.2 mt . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.513 179.746 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 CA--C 1.521 -0.162 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.492 ' CD2' ' HZ1' ' A' ' 193' ' ' LYS . 11.4 mt -60.93 -46.86 88.98 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.539 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.507 ' HB3' HH21 ' A' ' 195' ' ' ARG . 56.5 mtpt -74.36 -32.52 62.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 11.2 tm-20 -68.08 -44.81 75.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.364 . . . . 0.0 111.296 -178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.492 ' HZ1' ' CD2' ' A' ' 190' ' ' LEU . 17.4 pttt -73.47 -43.91 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.173 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.505 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.83 -40.83 88.12 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.854 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.507 HH21 ' HB3' ' A' ' 191' ' ' LYS . 17.9 ptp180 -67.36 -38.19 84.39 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.3 p -60.31 -41.15 92.88 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . 0.401 HG22 ' HD1' ' A' ' 145' ' ' HIS . 92.1 mt -64.3 -44.63 97.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.452 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.75 -40.85 98.53 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.961 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -60.4 -41.3 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.688 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.92 -40.15 98.48 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 36.2 mt -62.04 -42.86 99.63 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.109 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.538 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.4 OUTLIER -64.14 -35.27 80.23 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.474 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.3 tmt_? -60.98 -43.77 98.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.739 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . 0.438 ' O ' ' OG ' ' A' ' 208' ' ' SER . 31.6 mt -62.26 -40.25 95.58 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -64.99 -45.08 87.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.991 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.575 ' O ' ' N ' ' A' ' 210' ' ' GLN . 82.7 mtp180 -65.21 -44.43 88.36 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.146 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.459 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -68.31 -40.87 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.131 0.491 . . . . 0.0 110.345 -179.459 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.444 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 68.4 m -60.28 -37.91 81.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.473 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -95.42 -46.66 6.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.636 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' A' ' 206' ' ' ARG . 54.9 tt0 -81.3 -35.65 30.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.109 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.519 0.297 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.709 ' O ' HG13 ' A' ' 223' ' ' VAL . 2.7 tm-20 . . . . . 0 CA--C 1.502 -0.873 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.507 ' O ' ' CG1' ' A' ' 223' ' ' VAL . 4.2 mp0 61.56 148.19 0.09 OUTLIER Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.226 -177.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.475 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 74.3 Cg_endo -79.3 169.99 18.11 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.396 2.064 . . . . 0.0 111.759 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 89.6 mtm180 69.59 -46.77 0.59 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.517 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.788 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 3.4 p -57.64 -97.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.798 0 CA-C-O 121.458 0.647 . . . . 0.0 111.831 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.788 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 0.3 OUTLIER -42.92 -29.07 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.333 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 223' ' ' VAL . 98.5 m-20 -62.51 -44.84 95.37 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 223' ' ' VAL . 1.5 mp -59.99 -40.18 88.28 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . 0.474 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 33.3 m0 -59.68 -43.0 94.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.783 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -67.75 -27.26 66.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.462 ' O ' ' C ' ' A' ' 230' ' ' ALA . 2.0 mt -63.08 -46.27 88.18 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.411 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.537 ' O ' ' C ' ' A' ' 231' ' ' GLN . . . -35.54 -67.25 0.16 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.814 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.537 ' C ' ' O ' ' A' ' 230' ' ' ALA . 12.8 tt0 24.62 -103.73 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.937 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.0 p -113.47 27.84 9.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.331 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.86 81.85 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.327 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -175.34 72.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.682 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.61 -169.25 2.3 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.741 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 236' ' ' THR . . . . . 0.414 ' OG1' ' OE1' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -110.46 -152.56 0.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.764 -178.902 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -92.53 -59.54 2.05 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.117 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.08 -42.8 99.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . 0.414 ' OE1' ' OG1' ' A' ' 236' ' ' THR . 89.2 mt-10 -60.18 -34.0 72.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.602 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.75 -44.4 96.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.292 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -64.89 -47.73 76.74 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.665 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.25 99.2 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.785 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.487 ' O ' ' HG2' ' A' ' 246' ' ' GLU . 1.3 t80 -61.82 -47.58 84.47 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.007 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.25 -42.53 98.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.572 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -59.09 -57.88 11.1 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.396 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 243' ' ' PHE . 13.3 pt-20 -58.99 -38.87 80.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.948 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 243' ' ' PHE . 1.9 mm? -61.55 -41.98 98.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.381 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.408 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 65.9 tttm -61.09 -42.23 98.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.157 0.503 . . . . 0.0 109.858 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -65.91 -39.5 90.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.801 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -61.84 -48.49 80.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.562 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 13.7 pt-20 -62.01 -41.87 98.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.079 0.466 . . . . 0.0 110.114 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.83 -38.2 89.82 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.152 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -61.96 -62.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.247 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.13 -37.21 13.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.03 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -65.35 -46.35 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.688 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -62.98 -43.31 99.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -58.07 -43.87 87.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.863 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.11 -40.65 94.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.252 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . 0.422 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 83.1 t60 -59.18 -47.61 84.67 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.297 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -62.7 -37.43 86.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.363 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -57.77 -47.66 81.88 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 120.993 0.425 . . . . 0.0 110.4 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -61.76 -43.24 99.25 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.042 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . 0.422 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 4.6 mp0 -60.46 -39.02 86.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.902 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.98 -41.84 98.48 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.338 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.92 -48.02 83.75 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-O 121.118 0.485 . . . . 0.0 110.44 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.3 mt -63.03 -43.49 99.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.157 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.12 85.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.27 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.53 -47.73 84.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.222 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -63.31 -45.0 93.37 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.992 0.425 . . . . 0.0 110.676 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -61.33 -42.88 99.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.469 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 1.8 tt -60.8 -42.66 98.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.907 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -59.69 -44.07 93.78 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.257 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -71.59 -34.05 69.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.88 0.371 . . . . 0.0 110.509 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . 0.407 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -62.84 -37.24 86.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.07 -25.36 66.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.871 0.367 . . . . 0.0 110.537 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 67.4 m -87.95 2.72 50.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.874 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.462 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 11.0 p -60.47 -44.47 96.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.652 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.462 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 156.9 -99.26 0.18 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -61.97 -40.93 97.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 0.0 110.258 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.5 32.81 40.9 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -66.68 -36.8 83.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.836 0.351 . . . . 0.0 110.738 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -77.49 -6.75 54.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.99 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.99 -44.99 99.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.8 t -60.5 -45.32 94.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.149 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.96 -45.84 93.14 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.992 0.425 . . . . 0.0 110.756 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 50.5 m -60.63 -41.9 95.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.182 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -62.23 -40.6 96.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.587 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.02 -57.02 14.93 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -64.62 -35.93 82.6 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.304 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -52.68 -46.99 67.47 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.47 -37.66 80.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.47 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 19.6 tp -61.25 -51.12 70.25 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.712 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.56 -41.29 98.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.044 0.45 . . . . 0.0 109.979 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -65.34 -35.04 79.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.077 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.5 -50.07 67.92 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -62.17 -42.74 99.55 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.611 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.4 m -61.28 -48.71 80.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.472 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.33 -41.93 98.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.171 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -62.28 -40.23 95.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.1 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -43.63 98.32 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.128 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.68 98.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.72 -44.61 96.58 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.043 0.449 . . . . 0.0 110.513 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.4 m -60.28 -44.44 95.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.449 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.09 -42.54 90.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.926 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.56 -51.38 70.15 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 110.809 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.67 -43.41 96.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.24 -36.41 83.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.993 0.425 . . . . 0.0 109.981 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . 0.473 ' O ' ' OG ' ' A' ' 312' ' ' SER . 12.2 mt -60.35 -44.55 95.45 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.138 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . 0.439 ' O ' ' OG ' ' A' ' 312' ' ' SER . 96.5 mm-40 -70.91 -57.3 4.72 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.543 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.86 -49.9 75.62 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.676 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 12.9 tp -62.59 -41.63 99.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.508 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 312' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 37.5 p -59.47 -40.59 87.43 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.439 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.93 -41.06 95.6 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -61.74 -44.62 96.55 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.724 -0.28 . . . . 0.0 110.86 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 2.7 mm -65.01 -41.99 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.0 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.6 t -47.65 -42.67 24.99 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 . . . . . 0 C--N 1.327 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.281 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 . . . . . 0 N--CA 1.46 0.049 0 CA-C-O 120.682 0.277 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -62.85 -34.8 78.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.06 147.51 46.01 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.744 0.783 . . . . 0.0 111.222 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -63.57 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.557 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -55.57 -48.61 74.51 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.388 0.613 . . . . 0.0 109.954 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.74 -38.78 91.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.327 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -62.63 -39.03 92.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.573 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.78 -47.28 87.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.511 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.425 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.8 mm? -60.64 -41.85 95.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.048 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.491 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 49.5 t-105 -60.03 -45.23 93.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.282 0.563 . . . . 0.0 110.435 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -56.9 -43.76 81.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.153 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -60.62 -41.72 95.39 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.338 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.95 86.78 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.076 0.465 . . . . 0.0 110.046 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.491 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 76.5 mt-30 -62.6 -37.86 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -60.6 -43.9 96.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.401 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.12 -38.89 92.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.57 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.87 105.66 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.756 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -127.53 154.39 77.51 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.631 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -38.57 155.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.791 2.327 . . . . 0.0 112.144 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.37 -43.25 18.67 Favored 'Trans proline' 0 C--N 1.307 -1.639 0 C-N-CA 122.675 2.25 . . . . 0.0 112.403 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 76.9 t -63.66 -47.16 92.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.472 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -64.08 -41.75 97.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.3 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.434 ' C ' ' CD2' ' A' ' 42' ' ' LEU . 8.5 tt -61.93 -43.47 98.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.33 -41.54 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.234 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.51 -44.66 74.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.1 tp -62.73 -49.2 75.98 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.961 0.41 . . . . 0.0 110.462 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -59.81 -42.06 92.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.47 -38.93 93.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.606 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -60.34 -52.42 65.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.096 0.474 . . . . 0.0 110.455 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.01 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.253 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.09 -45.73 83.14 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.286 0.565 . . . . 0.0 110.187 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.38 -42.78 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.661 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 tp60 -52.97 -41.83 64.95 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -63.43 -40.74 97.98 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -61.51 -43.58 98.61 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.467 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -60.54 -42.23 96.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.539 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.56 -47.59 79.14 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.323 0.583 . . . . 0.0 109.889 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.54 -39.74 88.99 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.34 0.59 . . . . 0.0 109.811 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.72 87.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.612 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 68.7 t90 -57.21 -39.92 76.42 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -58.42 -46.69 85.98 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.24 -43.52 96.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.308 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -62.19 -40.41 95.97 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.015 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -58.5 -43.62 89.14 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.1 mt . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.775 179.344 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.849 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.55 -37.62 88.03 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.439 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -60.42 -47.11 87.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.067 0.461 . . . . 0.0 110.251 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -59.81 -43.5 94.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.363 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.69 -37.95 86.01 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.522 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.05 -41.69 99.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.89 -43.73 95.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.29 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.401 HD11 HG21 ' A' ' 78' ' ' ILE . 96.6 mt -64.22 -44.5 97.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.076 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 44.9 ttm180 -59.09 -42.45 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.063 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -62.72 -40.46 97.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.556 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.423 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.41 -48.45 80.61 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.89 -179.574 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -64.9 -38.88 92.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.659 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 61.4 t -62.52 -46.4 96.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 94.1 mt -60.49 -48.2 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.066 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.01 -40.86 95.54 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.068 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.37 -47.35 85.76 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.805 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.14 -47.58 82.14 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.116 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -66.15 -27.22 67.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.448 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 68.27 24.98 74.83 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 97.2 mt . . . . . 0 C--N 1.33 -0.254 0 CA-C-O 120.831 0.348 . . . . 0.0 110.827 179.945 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 7.2 mp . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.942 0.401 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.617 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.5 mt-10 -60.45 -32.65 71.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.642 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.4 mtmt -62.09 -45.91 91.43 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.905 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 47.6 mt -69.02 -46.59 67.58 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.459 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 8.4 t-105 -62.95 -44.47 95.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.542 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.617 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -69.47 -38.94 77.95 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.164 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.521 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.0 mptt -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.173 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.26 -45.57 66.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.791 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.405 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 65.3 tttm -48.25 -46.08 35.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.136 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 18.2 m -109.65 -60.2 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.643 -0.423 . . . . 0.0 112.005 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.64 -11.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.748 -178.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 0.432 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -134.13 -3.74 3.09 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.417 ' C ' ' H ' ' A' ' 131' ' ' SER . 67.4 mttm 56.91 12.75 1.27 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.265 0.555 . . . . 0.0 109.756 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.432 ' CD1' ' O ' ' A' ' 128' ' ' GLY . 6.0 m-30 -68.86 50.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.669 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.417 ' H ' ' C ' ' A' ' 129' ' ' LYS . 5.6 p -96.15 118.15 32.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.731 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 119.93 -97.97 0.69 Allowed Glycine 0 CA--C 1.53 0.979 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.492 178.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -78.85 -43.57 24.81 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.268 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.523 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.0 mp0 -60.67 -47.39 86.48 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.555 -0.458 . . . . 0.0 109.851 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.0 mt -62.87 -41.62 99.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.018 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.39 -40.57 94.83 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.999 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.6 -42.27 99.47 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.077 0.465 . . . . 0.0 110.173 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.59 -43.97 93.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.426 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -67.06 -37.7 84.48 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 144' ' ' HIS . 52.6 mtp180 -53.32 -43.93 68.01 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -71.5 -40.85 69.92 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.669 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.426 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.9 m-85 -59.01 -57.91 10.99 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.568 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 44.3 mt -60.72 -39.06 87.22 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.299 -0.561 . . . . 0.0 110.254 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.44 ' CD2' ' O ' ' A' ' 140' ' ' ARG . 4.0 m170 -51.32 -48.05 62.49 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -63.27 -39.86 95.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.664 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt -61.04 -41.56 96.81 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.318 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -67.68 -53.11 30.36 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 120.77 0.319 . . . . 0.0 111.577 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -61.3 -44.04 97.87 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.808 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.4 t -62.08 -43.86 98.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.747 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.682 ' O ' ' OD1' ' A' ' 153' ' ' ASN . 2.3 m170 -60.14 -41.59 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.56 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -64.79 -37.82 88.9 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.514 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -68.39 -50.67 51.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.131 0.491 . . . . 0.0 111.141 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . 0.804 ' OD1' ' N ' ' A' ' 154' ' ' VAL . 56.5 p30 -72.45 -38.43 68.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.865 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.804 ' N ' ' OD1' ' A' ' 153' ' ' ASN . 40.1 t -61.02 -46.45 96.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 71.4 mt . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.401 179.261 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 . . . . . 0 CA--C 1.519 -0.218 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.488 ' N ' HD13 ' A' ' 190' ' ' LEU . 9.5 mp -62.12 -42.92 99.71 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.623 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.525 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 23.7 mmtp -67.51 -39.54 85.14 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 83.0 tt0 -67.79 -47.68 68.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.997 0.427 . . . . 0.0 111.66 -179.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.472 ' HZ1' ' HG ' ' A' ' 190' ' ' LEU . 1.0 OUTLIER -73.13 -43.12 62.08 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.415 -179.315 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.527 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.94 -42.09 77.21 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.053 -179.648 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.563 ' CZ ' HE22 ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.51 -39.25 93.43 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.436 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 49.9 m -60.46 -43.76 96.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.41 -43.23 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.9 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -62.3 -41.53 98.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.847 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.563 HE22 ' CZ ' ' A' ' 195' ' ' ARG . 84.1 mt-30 -63.6 -38.52 91.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.579 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.87 -48.83 84.13 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.8 mt -62.84 -39.71 95.22 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.129 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.53 ' HB3' HH12 ' A' ' 206' ' ' ARG . 48.8 m-20 -62.31 -37.45 85.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.482 0.658 . . . . 0.0 109.419 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.409 ' C ' ' HD2' ' A' ' 203' ' ' ARG . 4.1 tmm_? -61.66 -41.96 98.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.145 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.5 mt -61.14 -39.62 90.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.434 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -60.95 -43.72 98.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.746 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.68 ' O ' ' N ' ' A' ' 210' ' ' GLN . 84.7 mtt85 -64.54 -39.8 94.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.234 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.604 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.1 t -63.62 -45.58 97.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.077 0.465 . . . . 0.0 110.236 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.06 -29.55 64.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.72 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -96.85 -16.75 20.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.274 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.68 ' N ' ' O ' ' A' ' 206' ' ' ARG . 18.8 mm100 -127.66 -37.89 1.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.781 0.324 . . . . 0.0 110.697 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.604 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.539 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 . . . . . 0 N--CA 1.448 -0.552 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.564 ' O ' ' N ' ' A' ' 222' ' ' ARG . 18.2 tt0 -170.21 131.39 0.95 Allowed Pre-proline 0 CA--C 1.533 0.305 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.778 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.419 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 76.5 Cg_exo -47.17 79.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.668 2.245 . . . . 0.0 112.233 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.564 ' N ' ' O ' ' A' ' 220' ' ' GLU . 0.7 OUTLIER 165.38 -46.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.606 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.687 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 2.1 p -61.48 -84.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.42 0.629 . . . . 0.0 111.228 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.687 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 1.1 mp -52.97 -26.66 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.062 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -63.15 -46.45 87.12 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.326 0.584 . . . . 0.0 109.864 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 17.5 mt -61.76 -40.75 96.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.362 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . 0.437 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 40.8 m0 -61.24 -37.1 81.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.957 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . 0.498 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 66.4 t0 -63.48 -37.17 86.28 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' A' ' 230' ' ' ALA . 95.7 mt -64.53 -42.24 95.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.442 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.587 ' O ' ' N ' ' A' ' 233' ' ' ALA . . . -29.97 -70.25 0.06 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.298 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 4.1 pt20 -38.0 -47.82 1.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.444 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.443 ' N ' ' O ' ' A' ' 229' ' ' LEU . 6.2 m -86.17 31.88 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.357 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . 0.587 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -150.51 111.06 4.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . 0.668 ' O ' ' HB2' ' A' ' 235' ' ' LEU . 65.0 t30 48.12 -142.6 0.48 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.228 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . 0.668 ' HB2' ' O ' ' A' ' 234' ' ' ASN . 60.6 mt 85.93 148.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.926 0.766 . . . . 0.0 110.746 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 236' ' ' THR . . . . . 0.571 ' H ' ' CD ' ' A' ' 239' ' ' GLU . 0.9 OUTLIER -100.23 -119.86 0.16 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.511 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . 0.568 ' N ' ' OE1' ' A' ' 239' ' ' GLU . 32.6 p-10 -122.06 -62.49 1.39 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.864 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.67 -42.16 99.48 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.185 0.517 . . . . 0.0 110.794 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . 0.581 ' N ' ' OE1' ' A' ' 239' ' ' GLU . 3.2 pm0 -58.5 -29.19 66.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.691 179.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . 0.532 ' N ' ' CD ' ' A' ' 239' ' ' GLU . 0.3 OUTLIER -67.17 -57.89 5.9 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.002 -179.153 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -55.37 -49.45 72.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.515 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.41 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.059 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 1.5 t80 -62.12 -44.86 95.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.238 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 59.4 ttm-85 -57.9 -48.54 79.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.972 0.415 . . . . 0.0 110.355 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.5 -39.27 85.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.628 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -58.9 -55.02 40.57 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.331 0.586 . . . . 0.0 110.344 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.443 ' CD2' ' N ' ' A' ' 247' ' ' LEU . 3.9 mm? -63.91 -34.31 77.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.688 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.7 tttt -57.73 -43.15 85.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 110.265 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -68.57 -43.59 76.25 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.351 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.6 -47.66 82.8 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.504 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.688 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.5 pp20? -60.82 -38.0 83.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.079 0.466 . . . . 0.0 109.756 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.01 -39.07 89.96 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.495 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -63.17 -47.43 82.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.487 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.433 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 11.3 tt -63.36 -34.83 69.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.072 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.77 -45.44 89.76 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.179 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.02 -43.35 99.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.139 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -43.44 79.41 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.015 0.436 . . . . 0.0 109.976 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -61.02 -41.29 96.27 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.311 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -58.93 -46.28 88.36 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.107 0.479 . . . . 0.0 110.355 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -61.18 -40.84 95.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.119 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.656 HE21 ' CG2' ' A' ' 297' ' ' THR . 88.2 mm-40 -56.47 -44.15 80.29 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.011 0.434 . . . . 0.0 110.089 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.3 -45.32 94.97 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.059 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -60.06 -38.32 82.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.11 -42.39 99.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.373 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -61.17 -47.55 85.67 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.058 0.456 . . . . 0.0 110.476 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.239 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.68 88.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -60.53 -49.21 78.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.357 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -62.7 -44.87 95.13 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.53 -39.8 92.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 4.2 tt -60.72 -45.43 94.26 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.448 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -61.78 -40.23 94.44 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.55 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 12.1 m80 -71.34 -41.39 69.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.914 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -67.97 -41.64 82.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.985 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -56.94 -17.62 10.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.57 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 29.5 m -61.16 -43.99 98.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.628 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 2.1 p -66.87 -35.9 75.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.507 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 76.69 37.65 34.0 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . 0.404 ' C ' ' OD1' ' A' ' 279' ' ' ASP . 59.9 t0 -59.79 -44.0 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.845 0.355 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 81.87 -4.12 76.51 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -94.04 -69.9 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.905 0.383 . . . . 0.0 110.375 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -70.77 -20.84 62.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.773 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 58.6 t -62.04 -47.83 91.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.587 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 46.5 t -63.94 -44.53 92.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.047 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.8 -42.31 99.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.649 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 286' ' ' SER . . . . . 0.402 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 39.9 t -62.32 -46.72 87.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.628 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -64.58 -39.55 93.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.949 0.404 . . . . 0.0 110.742 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -58.66 -58.11 10.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.153 0.502 . . . . 0.0 110.167 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -64.47 -31.98 73.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.901 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 286' ' ' SER . 58.1 t-80 -54.49 -51.34 65.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.865 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.32 82.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.462 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 15.6 tp -62.04 -49.63 75.24 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.779 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . 0.415 ' N ' HD12 ' A' ' 293' ' ' LEU . 9.9 mp -62.85 -41.67 99.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.941 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.465 ' O ' ' OG1' ' A' ' 297' ' ' THR . 68.8 mm-40 -61.09 -38.06 84.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.078 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.9 -45.22 96.13 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 16.8 tpp85 -61.21 -43.46 98.85 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.693 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.656 ' CG2' HE21 ' A' ' 261' ' ' GLN . 31.5 p -60.22 -43.5 95.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.433 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -63.89 -45.12 90.8 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.449 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.39 -40.78 97.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.267 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -44.08 97.64 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.186 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.8 -41.28 97.55 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -61.35 -46.03 91.94 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.157 0.503 . . . . 0.0 110.719 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.7 m -60.8 -44.38 96.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.56 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -61.08 -43.16 95.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.346 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.22 -49.55 76.66 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.111 0.481 . . . . 0.0 110.803 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -62.13 -44.37 96.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.458 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -66.82 -31.09 71.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.151 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.07 -47.9 83.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.064 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.49 -44.14 71.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.808 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -59.68 -51.93 67.67 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.013 0.435 . . . . 0.0 111.089 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . 0.489 ' O ' HG13 ' A' ' 315' ' ' ILE . 36.4 mt -62.57 -48.21 80.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.783 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 8.0 m -69.52 -12.89 62.02 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.693 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -79.57 -64.43 1.9 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 89.5 mmt-85 -68.76 -37.6 79.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.01 0.405 . . . . 0.0 110.972 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 311' ' ' LEU . 1.2 mm -57.5 -19.88 12.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.748 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.467 ' C ' ' O ' ' A' ' 315' ' ' ILE . 82.0 p -36.67 -33.8 0.06 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 315' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.53 0.203 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.924 177.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.673 0.273 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.491 HH21 ' CG ' ' A' ' 53' ' ' GLU . 80.4 mtm180 -64.19 -36.61 84.62 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.505 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 30.6 mtp -125.0 147.88 48.73 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.648 0.737 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.687 ' H ' ' CD ' ' A' ' 23' ' ' GLU . 2.0 pm0 -59.15 -32.03 69.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.86 -50.13 73.39 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.31 0.576 . . . . 0.0 110.588 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.33 -38.74 87.99 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.286 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.414 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 55.1 t-20 -63.45 -37.6 87.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.333 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.36 -48.25 82.55 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.297 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.413 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 4.1 mm? -61.06 -42.43 98.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.115 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.567 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 54.6 t-105 -61.81 -43.53 98.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -57.55 -44.25 85.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.207 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -61.42 -41.29 96.93 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.107 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.11 87.2 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.147 0.498 . . . . 0.0 110.129 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.567 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -63.43 -37.68 88.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.075 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -59.91 -44.37 94.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.317 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.36 -39.65 94.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.381 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.46 104.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.798 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.7 mt -121.95 154.3 61.01 Favored Pre-proline 0 C--O 1.233 0.214 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.616 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -40.53 154.11 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.513 2.142 . . . . 0.0 112.377 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.5 -43.67 49.15 Favored 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.521 2.147 . . . . 0.0 112.62 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -48.34 88.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.812 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -66.23 -38.54 88.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.564 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.9 tt -63.63 -43.56 96.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.66 -47.87 76.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.757 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -66.71 -41.81 87.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.614 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.4 tp -62.54 -48.57 78.92 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.541 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -60.25 -41.63 93.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.289 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.4 90.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.744 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.409 ' OD1' ' C ' ' A' ' 48' ' ' ASP . 61.3 t0 -60.4 -53.28 59.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.394 . . . . 0.0 110.688 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.86 -39.68 95.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.206 0.527 . . . . 0.0 110.487 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -56.8 -46.79 81.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.133 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.409 HG22 HD12 ' A' ' 51' ' ' ILE . 96.7 mt -63.09 -42.49 96.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.679 179.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -49.57 -45.58 47.9 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.491 ' CG ' HH21 ' A' ' 21' ' ' ARG . 42.1 tp10 -66.99 -36.47 82.24 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.359 -0.537 . . . . 0.0 109.599 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.59 -46.41 89.96 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -64.24 -40.08 95.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.503 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.6 -49.75 74.01 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.983 0.42 . . . . 0.0 110.259 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.82 -42.34 97.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.861 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.78 96.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -57.09 -42.66 81.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.202 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.59 -45.25 94.68 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.72 -45.43 81.89 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.256 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mp -62.36 -42.29 99.28 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.996 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -55.83 -43.99 77.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 41.1 tp . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.757 179.116 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.833 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -69.29 -36.95 77.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.737 0.303 . . . . 0.0 110.326 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -59.99 -59.58 5.19 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.961 0.41 . . . . 0.0 110.553 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -57.19 -40.03 76.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.129 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.6 -41.31 90.06 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.257 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -63.15 -42.28 99.42 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.4 mt -63.63 -43.68 96.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.161 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.57 -45.48 97.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.312 0.577 . . . . 0.0 110.06 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -59.46 -43.1 93.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.135 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.421 ' O ' HG13 ' A' ' 84' ' ' ILE . 96.0 m-20 -62.09 -39.68 93.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.374 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.409 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.72 -48.92 79.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.312 0.577 . . . . 0.0 109.874 -179.503 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -64.54 -38.74 92.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 70.4 t -63.5 -46.19 95.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.649 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.35 -49.49 83.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.313 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.62 -39.89 88.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.868 0.366 . . . . 0.0 110.788 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -58.36 -50.26 74.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.787 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.92 -43.87 97.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.806 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -62.91 -27.06 69.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.311 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.35 22.64 78.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.8 mt . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.93 0.395 . . . . 0.0 110.612 -179.962 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 80.8 mt . . . . . 0 C--O 1.237 0.407 0 CA-C-O 120.879 0.371 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.5 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 94.9 mt-10 -54.56 -28.68 47.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.476 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.553 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.8 mttt -62.37 -48.14 81.1 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.795 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.53 -44.41 78.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.439 . . . . 0.0 112.013 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.42 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 10.3 t-105 -56.54 -53.67 54.83 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.795 -178.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.5 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 8.2 m-70 -67.6 -31.8 72.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.49 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.589 ' O ' ' OG ' ' A' ' 127' ' ' SER . 13.8 tptt -57.33 -50.68 72.19 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.052 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.09 -46.84 64.04 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.806 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -50.6 -48.08 57.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.004 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.2 m -85.05 -39.35 18.1 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.589 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 17.0 m -45.75 -30.86 1.76 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.096 -178.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -152.67 -90.17 0.08 OUTLIER Glycine 0 N--CA 1.464 0.541 0 C-N-CA 119.993 -1.099 . . . . 0.0 111.184 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.78 23.3 0.06 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.432 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -67.5 50.48 0.05 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.401 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.43 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.3 m -104.3 118.48 36.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.013 0.435 . . . . 0.0 111.812 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 111.94 -98.04 0.97 Allowed Glycine 0 CA--C 1.53 1.008 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.531 178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.532 ' O ' ' OD2' ' A' ' 136' ' ' ASP . 12.8 pt-20 -73.78 -42.16 61.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.213 0.53 . . . . 0.0 111.149 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.454 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.7 mp0 -59.24 -48.29 82.18 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.258 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.08 -40.48 95.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.127 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.532 ' OD2' ' O ' ' A' ' 133' ' ' GLU . 0.0 OUTLIER -62.12 -39.31 92.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.075 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -63.1 -43.94 97.08 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 110.02 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.8 mm? -59.95 -42.21 93.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -33.54 76.14 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.69 177.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.589 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 82.0 mmt-85 -58.67 -41.48 86.25 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.67 -40.55 76.34 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.568 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -58.93 -58.45 8.58 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.137 0.494 . . . . 0.0 110.481 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.47 -36.97 77.01 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.049 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.589 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 49.0 m170 -54.17 -42.4 69.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -65.98 -36.81 84.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.451 ' O ' HG13 ' A' ' 149' ' ' VAL . 70.2 mmtt -59.85 -45.89 90.99 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.47 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.422 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.7 pt-20 -71.42 -47.89 53.05 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.412 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.422 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 49.0 mtmt -63.2 -46.64 86.08 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.178 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . 0.451 HG13 ' O ' ' A' ' 146' ' ' LYS . 6.5 p -62.86 -36.5 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.224 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.563 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -65.33 -40.6 93.88 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.402 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 155' ' ' LEU . 79.2 mm-40 -64.27 -39.87 94.82 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.534 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.437 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 22.1 m-85 -62.54 -49.13 76.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . 0.541 ' OD1' ' HA ' ' A' ' 150' ' ' HIS . 0.9 OUTLIER -74.57 -42.57 58.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.003 0.43 . . . . 0.0 111.004 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.563 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 70.8 t -61.61 -45.65 98.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.892 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . 0.413 ' CG ' ' O ' ' A' ' 151' ' ' GLU . 77.9 mt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.197 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 . . . . . 0 CA--C 1.52 -0.196 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.584 ' CD2' ' HZ1' ' A' ' 193' ' ' LYS . 3.6 mt -62.15 -46.25 89.82 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.882 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 66.2 mttm -71.73 -40.71 69.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.442 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.466 ' O ' ' OG ' ' A' ' 196' ' ' SER . 94.1 mt-10 -68.51 -43.76 76.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.827 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.584 ' HZ1' ' CD2' ' A' ' 190' ' ' LEU . 22.6 pttt -72.31 -43.81 63.64 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.215 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.572 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.02 -42.9 72.38 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.777 -179.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.515 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -66.03 -37.05 84.9 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 192' ' ' GLU . 57.7 m -59.37 -42.55 91.91 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.41 ' OD1' ' C ' ' A' ' 198' ' ' ASN . 32.8 t-20 -62.54 -42.53 99.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.768 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -64.93 -34.15 77.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.381 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.05 -46.79 92.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.281 -1.127 . . . . 0.0 110.281 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 30.2 mt -62.69 -42.26 99.54 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.376 -0.53 . . . . 0.0 109.946 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -62.88 -36.66 84.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.468 ' HD2' ' O ' ' A' ' 203' ' ' ARG . 15.4 tpt180 -64.23 -41.56 96.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.821 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.25 -38.52 80.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -65.58 -42.15 92.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.623 ' O ' ' N ' ' A' ' 210' ' ' GLN . 79.1 mtt85 -65.74 -36.74 84.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.087 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.651 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.33 -45.99 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.04 0.448 . . . . 0.0 110.127 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 90.0 p -70.25 -27.25 64.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.539 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -98.06 -14.22 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.623 ' N ' ' O ' ' A' ' 206' ' ' ARG . 53.3 tt0 -137.17 -36.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.775 0.322 . . . . 0.0 110.745 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.651 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.521 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 . . . . . 0 C--O 1.233 0.213 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.631 ' O ' ' O ' ' A' ' 221' ' ' PRO . 3.1 tm-20 -59.19 128.91 85.99 Favored Pre-proline 0 C--N 1.329 -0.325 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.236 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.669 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 76.8 Cg_exo -47.09 -155.9 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.611 2.207 . . . . 0.0 111.772 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.669 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 83.5 mtp180 85.81 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.71 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.413 ' CG1' ' N ' ' A' ' 224' ' ' ILE . 7.5 p -61.07 -51.71 70.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.413 ' N ' ' CG1' ' A' ' 223' ' ' VAL . 0.6 OUTLIER -64.35 -32.72 58.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.332 0.586 . . . . 0.0 109.516 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -63.25 -39.35 94.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.477 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.7 mt -61.29 -40.89 95.83 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 43.6 m0 -59.61 -40.08 86.33 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.029 -0.668 . . . . 0.0 110.057 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 49.6 m-20 -63.52 -36.94 85.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.654 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.621 ' C ' ' H ' ' A' ' 231' ' ' GLN . 13.0 mt -63.85 -41.07 97.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.311 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -59.2 4.95 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.974 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.621 ' H ' ' C ' ' A' ' 229' ' ' LEU . 5.4 pt20 -64.27 -40.96 97.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.839 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 18.8 p -154.03 23.39 0.5 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.522 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -60.87 -47.63 85.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.677 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -176.9 65.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.55 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 94.1 mt -133.42 157.11 46.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.083 0.468 . . . . 0.0 110.675 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 22.0 p -78.95 171.23 15.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.49 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -64.55 -45.25 87.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.996 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.91 -45.61 92.99 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.25 0.548 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -64.64 -33.79 76.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.696 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -42.8 99.83 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.508 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . 0.582 ' OE2' ' NH2' ' A' ' 244' ' ' ARG . 53.1 tp10 -63.73 -47.72 79.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.197 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.95 -42.75 99.47 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.359 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.587 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.1 OUTLIER -69.87 -30.27 67.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.447 179.406 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . 0.582 ' NH2' ' OE2' ' A' ' 241' ' ' GLU . 57.8 ttp180 -65.03 -58.61 5.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.089 0.471 . . . . 0.0 110.691 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -66.32 -39.38 89.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.088 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -57.74 -55.88 29.09 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.304 0.574 . . . . 0.0 110.495 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 247' ' ' LEU . 3.8 mm? -63.77 -33.2 75.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.386 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.621 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.8 tttt -58.75 -42.74 89.57 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.28 0.562 . . . . 0.0 110.272 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . 0.509 ' HD1' ' NZ ' ' A' ' 253' ' ' LYS . 6.4 m-70 -68.89 -43.67 74.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.241 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -61.27 -50.16 74.16 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.433 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.621 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.6 pp20? -60.24 -37.13 79.41 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.7 81.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.548 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . 0.509 ' NZ ' ' HD1' ' A' ' 249' ' ' HIS . 13.9 mptt -63.55 -48.64 76.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.36 -38.99 83.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.058 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -59.44 -54.7 43.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.291 0.567 . . . . 0.0 110.434 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -63.43 -40.6 97.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.915 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . 0.485 ' NE2' ' O ' ' A' ' 297' ' ' THR . 28.4 t-80 -54.28 -47.2 72.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.12 0.486 . . . . 0.0 109.967 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . 0.407 ' O ' ' HB2' ' A' ' 261' ' ' GLN . 60.4 t-20 -61.64 -41.07 96.98 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.174 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -56.34 -45.5 80.36 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 121.098 0.475 . . . . 0.0 109.947 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -63.79 -34.91 78.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.049 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 257' ' ' HIS . 26.6 mt-30 -58.57 -47.59 83.75 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -61.58 -45.87 92.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.103 0.478 . . . . 0.0 109.754 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -64.85 -33.07 75.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.006 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 47.2 tp -62.36 -43.78 98.01 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.92 0.391 . . . . 0.0 110.268 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -65.91 -46.01 79.84 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.208 0.527 . . . . 0.0 110.444 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.18 -43.63 98.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.311 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.99 86.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.135 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.69 -45.55 93.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -60.08 -48.99 79.43 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.217 0.532 . . . . 0.0 110.65 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -62.15 -39.2 91.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.56 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 275' ' ' GLU . 4.8 tt -60.49 -44.26 96.14 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.965 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 63.0 ttm-85 -60.2 -43.12 96.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.157 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -66.48 -39.84 89.0 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.651 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.35 84.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 271' ' ' LEU . 96.1 mt-10 -49.64 -19.18 0.55 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.848 0.356 . . . . 0.0 110.396 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 276' ' ' SER . . . . . 0.754 ' O ' ' N ' ' A' ' 278' ' ' GLY . 58.6 m -82.81 -75.89 0.29 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.814 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.506 ' C ' ' O ' ' A' ' 276' ' ' SER . 44.1 t 24.29 -77.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 O-C-N 123.686 0.616 . . . . 0.0 110.831 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.754 ' N ' ' O ' ' A' ' 276' ' ' SER . . . 161.17 -77.67 0.17 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.287 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -86.55 123.05 31.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.883 0.373 . . . . 0.0 110.474 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -67.64 144.1 43.24 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -174.92 -46.42 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -96.1 -6.09 39.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.723 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 67.0 t -62.22 -46.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.512 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.39 -46.19 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.071 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.38 -45.41 94.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.5 t -62.11 -42.82 99.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.635 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -63.22 -40.94 98.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.79 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -60.71 -54.31 46.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.364 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.8 mmtm -65.09 -33.81 76.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.158 179.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -57.92 -49.01 78.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.271 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -70.07 -38.22 75.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.747 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 2.7 tp -61.62 -50.24 73.37 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.254 -0.579 . . . . 0.0 110.175 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . 0.436 ' O ' ' OG1' ' A' ' 297' ' ' THR . 0.9 OUTLIER -63.55 -41.97 98.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.008 179.725 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -62.23 -42.46 99.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.19 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -60.93 -47.77 89.59 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 20.3 tpp85 -61.9 -37.34 84.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.437 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.485 ' O ' ' NE2' ' A' ' 257' ' ' HIS . 3.6 m -59.64 -52.24 66.37 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.399 0.618 . . . . 0.0 110.189 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.14 -39.26 92.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -58.23 -45.64 87.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.294 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -44.11 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.132 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -54.96 -44.29 82.62 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -62.49 -43.37 98.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.129 0.49 . . . . 0.0 110.665 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 303' ' ' THR . . . . . 0.523 HG22 ' HD1' ' A' ' 307' ' ' HIS . 17.9 m -59.08 -44.76 91.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.578 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.06 -41.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.202 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -56.52 -57.09 13.83 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-O 121.44 0.638 . . . . 0.0 111.075 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 4.7 mtpt -62.41 -39.94 94.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.723 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.523 ' HD1' HG22 ' A' ' 303' ' ' THR . 4.6 m80 -64.24 -35.7 81.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.106 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 15.4 mt -61.81 -43.93 97.86 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.397 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -67.32 -45.73 75.59 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.998 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.54 -49.67 75.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.963 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 21.9 mt -63.85 -40.63 97.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.856 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 69.4 m -57.7 -43.8 85.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.358 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.49 -43.38 86.94 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 317' ' ' ARG . 7.0 mpt_? -63.66 -45.64 89.22 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.773 0.321 . . . . 0.0 111.058 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -73.17 -23.35 19.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.126 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 38.4 t -59.18 -43.71 92.18 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 314' ' ' ARG . 10.8 tpp180 . . . . . 0 C--N 1.326 -0.422 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.802 0.334 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -63.74 -39.23 93.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.816 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 93.4 mmm -125.31 153.5 43.18 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.056 0.455 . . . . 0.0 110.875 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -60.75 -37.42 81.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.572 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.6 tttp -58.06 -47.16 83.99 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.261 0.553 . . . . 0.0 110.615 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.05 -39.78 93.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.359 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -64.06 -38.66 91.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.11 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.3 -46.37 88.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.433 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.0 mt -61.7 -43.19 99.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.094 0.473 . . . . 0.0 109.87 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.597 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 52.6 t-105 -61.62 -43.39 98.94 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.214 0.531 . . . . 0.0 110.233 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -57.66 -42.11 82.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.029 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.58 -41.63 97.7 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.159 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.62 87.46 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.124 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.597 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -62.89 -36.99 85.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.055 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -60.99 -43.14 99.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.337 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -63.56 -39.67 95.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.384 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.81 106.94 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -130.42 154.82 81.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.795 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -37.96 155.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.776 2.317 . . . . 0.0 112.055 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.64 -39.87 11.18 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.546 2.164 . . . . 0.0 112.248 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.28 -48.68 84.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.999 0.428 . . . . 0.0 110.534 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -68.29 -39.54 82.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.711 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -62.9 -44.09 97.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.526 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.65 94.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.274 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -66.87 -46.59 74.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.569 HD13 ' OH ' ' A' ' 88' ' ' TYR . 5.2 tt -63.47 -45.78 89.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.547 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -58.39 -43.34 88.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.107 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.472 ' O ' HG13 ' A' ' 51' ' ' ILE . . . -63.14 -41.71 99.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.642 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -56.55 -51.64 67.81 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.917 0.389 . . . . 0.0 110.734 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.84 -38.57 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.372 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -57.79 -45.07 86.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.201 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 47' ' ' ALA . 2.2 mt -63.5 -42.67 97.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.475 ' NE2' HD21 ' A' ' 80' ' ' ASN . 29.5 mm-40 -51.67 -46.19 63.71 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.673 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -64.62 -38.7 91.89 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.908 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -61.52 -44.59 96.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.96 0.409 . . . . 0.0 110.406 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -62.3 -41.57 98.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.377 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -57.3 -49.55 75.73 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.749 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.09 -41.95 93.57 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.967 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.641 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.8 t90 -59.1 -41.98 89.41 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.096 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -63.6 -45.16 91.59 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -57.57 -51.57 68.94 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.73 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 pp -65.34 -39.15 92.03 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.808 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -58.25 -42.28 86.05 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 38.3 tp . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.637 178.65 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.614 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -62.42 -31.44 72.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.696 0.284 . . . . 0.0 110.275 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.89 -52.64 64.54 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.047 0.451 . . . . 0.0 110.271 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -61.14 -42.17 98.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.08 179.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.01 90.58 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.239 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -61.19 -43.14 99.35 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.36 -44.05 97.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.39 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.53 -46.9 91.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 120.97 0.414 . . . . 0.0 110.283 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -62.88 -42.49 99.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.229 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.475 HD21 ' NE2' ' A' ' 52' ' ' GLN . 33.3 t30 -64.01 -39.67 94.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.449 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.412 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.71 -48.55 81.21 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.632 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -64.86 -39.32 93.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.586 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 79.4 t -62.84 -45.62 98.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.343 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -61.38 -48.61 88.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.583 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.26 -41.61 94.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.893 0.377 . . . . 0.0 110.542 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.52 89.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.721 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -63.41 -47.95 79.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.596 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.569 ' OH ' HD13 ' A' ' 45' ' ' LEU . 17.9 m-85 -68.87 -30.9 69.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.505 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.48 25.26 36.58 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt . . . . . 0 N--CA 1.462 0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.529 179.664 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 53.7 mt . . . . . 0 C--O 1.237 0.424 0 CA-C-O 121.186 0.517 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.676 ' OE1' ' NE2' ' A' ' 122' ' ' HIS . 27.0 mm-40 -56.04 -25.08 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.194 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 53.4 mttp -61.27 -49.06 78.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.28 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.38 -45.09 70.15 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.998 0.428 . . . . 0.0 111.622 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.412 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 8.6 t-105 -57.72 -49.72 75.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.324 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.676 ' NE2' ' OE1' ' A' ' 118' ' ' GLU . 12.6 m-70 -66.27 -35.6 80.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.385 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 127' ' ' SER . 14.0 tptt -55.83 -50.89 69.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.819 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.489 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.46 -47.38 64.16 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.105 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -53.98 -51.85 62.59 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.789 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -75.02 -43.91 50.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.005 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 22.4 p -46.6 -28.16 1.36 Allowed 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -178.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.49 -95.42 0.11 Allowed Glycine 0 CA--C 1.519 0.314 0 C-N-CA 119.996 -1.097 . . . . 0.0 111.525 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.04 32.23 0.08 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.563 ' CG ' ' OE1' ' A' ' 134' ' ' GLU . 3.9 m-85 -66.81 49.85 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.469 -179.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.7 m -104.11 124.11 48.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.008 0.433 . . . . 0.0 111.995 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 109.2 -97.49 1.06 Allowed Glycine 0 CA--C 1.53 0.976 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.384 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -78.62 -43.31 26.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.858 0.361 . . . . 0.0 111.329 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.563 ' OE1' ' CG ' ' A' ' 130' ' ' PHE . 56.7 mt-10 -60.58 -51.35 69.8 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.209 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.4 mt -63.27 -42.86 99.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.502 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -61.17 -42.0 97.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.568 ' HA ' ' HE ' ' A' ' 140' ' ' ARG . 97.1 mttt -61.88 -41.1 97.48 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.167 0.508 . . . . 0.0 110.002 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.66 -41.73 91.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -34.16 77.4 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 177.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.581 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 53.9 mtm180 -57.56 -45.99 84.47 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.842 -1.143 . . . . 0.0 108.202 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -71.9 -38.1 70.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.938 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.88 -58.25 9.45 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.786 -179.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.65 -40.73 95.96 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.066 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.581 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 47.6 m170 -56.74 -44.34 81.58 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.726 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -60.67 -42.39 96.98 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.606 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -60.54 -43.48 97.14 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.744 -0.383 . . . . 0.0 111.386 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.518 ' HA ' ' HD1' ' A' ' 150' ' ' HIS . 98.6 mt-10 -65.98 -55.78 15.02 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.703 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.23 -42.68 99.26 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.56 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.56 -45.42 98.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.144 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.659 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 1.1 p-80 -65.5 -36.27 83.35 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.931 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.602 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 94.2 mt-10 -59.39 -46.23 89.26 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.997 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -61.72 -45.18 95.06 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.684 -0.406 . . . . 0.0 109.955 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.65 -39.29 91.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.15 -47.84 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 62.6 mt . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.51 179.147 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 . . . . . 0 CA--C 1.523 -0.08 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 7.6 mt -61.97 -47.54 84.38 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.444 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.493 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.6 mtmt -70.22 -37.73 75.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.939 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -67.67 -51.02 54.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.46 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 18.4 pttt -67.13 -42.9 83.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.313 -179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.515 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -70.06 -40.49 75.05 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.632 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.493 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 25.3 mmt180 -64.06 -39.5 94.22 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.244 -0.583 . . . . 0.0 109.643 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 78.4 p -62.68 -44.3 96.6 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.456 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.97 -44.4 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.91 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -63.37 -41.56 98.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.826 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 70.6 mt-30 -66.03 -29.54 69.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.123 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.59 -47.22 63.37 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 32.8 mt -64.44 -42.89 95.72 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.873 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.826 ' OD1' ' O ' ' A' ' 199' ' ' GLN . 0.4 OUTLIER -65.85 -35.38 80.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.0 tmt_? -63.42 -42.93 98.74 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.19 -40.57 96.52 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -62.65 -42.66 99.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.867 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.767 ' O ' ' N ' ' A' ' 210' ' ' GLN . 67.9 mtp180 -65.23 -38.34 90.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.064 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.459 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 52.9 t -64.07 -47.64 89.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.906 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.8 m -71.16 -29.5 65.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.496 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -93.93 -42.27 9.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.372 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.767 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.7 tt0 -105.04 -35.83 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.11 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.459 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.487 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 . . . . . 0 CA--C 1.528 0.107 0 CA-C-O 120.708 0.289 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -56.06 157.47 8.52 Favored Pre-proline 0 C--O 1.232 0.178 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.912 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.484 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 35.3 Cg_exo -56.88 -171.36 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.373 2.049 . . . . 0.0 111.863 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.484 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 0.2 OUTLIER 82.82 -85.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.87 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.681 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 4.7 p -62.46 -69.22 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.727 0 CA-C-O 121.321 0.581 . . . . 0.0 111.838 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.681 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 0.5 OUTLIER -56.57 -34.33 41.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . 0.418 ' HB2' ' N ' ' A' ' 222' ' ' ARG . 6.4 m-20 -64.42 -37.0 86.0 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.089 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.45 -42.81 96.9 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . 0.43 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 42.7 m0 -61.73 -38.75 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.15 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -61.54 -38.28 86.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 231' ' ' GLN . 92.3 mt -64.7 -42.06 95.55 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.482 0.658 . . . . 0.0 110.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -45.38 -19.23 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.902 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.447 ' N ' ' O ' ' A' ' 229' ' ' LEU . 8.9 tt0 -75.13 -69.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.628 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.439 ' O ' ' O ' ' A' ' 233' ' ' ALA . 5.0 m -73.3 -19.05 61.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.562 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -44.04 -96.0 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.668 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -168.87 93.7 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.703 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 85.8 mt -141.24 163.83 31.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.649 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.2 p -78.37 166.15 22.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.64 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 237' ' ' ASP . 60.0 t0 -66.07 -48.74 69.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.154 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -62.13 -46.74 87.66 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.123 0.487 . . . . 0.0 110.451 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -62.19 -40.02 94.65 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.292 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 17.3 mt -65.54 -34.2 77.7 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.772 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -63.67 -51.87 63.18 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.084 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -65.36 -41.8 93.43 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.344 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.449 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.7 OUTLIER -66.25 -43.06 87.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.403 179.318 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -58.94 -47.55 84.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.195 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -68.18 -42.6 79.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.703 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -57.03 -51.4 69.4 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.13 0.49 . . . . 0.0 110.43 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.479 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 2.3 mm? -63.62 -38.92 92.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.529 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.415 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 38.4 ttpt -54.82 -45.04 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -66.14 -40.1 90.34 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.552 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . 0.456 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 23.5 t80 -58.07 -50.15 74.44 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.317 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 7.7 pt-20 -62.81 -36.67 83.92 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.86 -38.52 86.51 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.563 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.81 -46.57 87.36 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.243 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -66.08 -39.82 85.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.172 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.19 -46.07 92.0 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.162 0.506 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -61.66 -44.84 96.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.966 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . 0.483 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -54.47 -43.02 71.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . 0.483 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 47.2 t30 -60.8 -41.25 95.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.305 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -59.99 -48.29 82.32 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.521 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -62.32 -36.22 81.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -60.58 -42.63 97.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.12 -47.56 85.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.124 0.487 . . . . 0.0 109.86 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -64.06 -35.67 81.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.922 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 62.8 tp -62.04 -41.81 98.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.954 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -63.85 -46.23 85.94 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 110.475 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 67.2 mt -62.74 -43.41 98.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.97 82.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.025 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -61.56 -46.2 90.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -58.09 -48.67 79.45 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.098 0.475 . . . . 0.0 110.119 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -62.46 -35.8 80.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.378 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 3.1 tt -59.07 -44.68 91.87 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -63.84 -41.25 97.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.276 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -66.04 -45.04 82.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.659 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . 0.45 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -62.32 -34.88 77.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.886 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . 0.403 ' OE2' ' CG1' ' A' ' 283' ' ' VAL . 41.6 mm-40 -57.67 -31.42 66.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.893 0.377 . . . . 0.0 110.342 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 5.4 m -87.15 6.79 31.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.926 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.461 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 12.3 p -60.38 -45.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.759 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.461 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 160.25 -113.0 0.55 Allowed Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -61.32 -47.86 83.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.716 0.294 . . . . 0.0 110.654 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . 0.451 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 135.14 -102.77 0.44 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 65.73 -60.43 0.28 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.931 0.396 . . . . 0.0 110.368 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -67.1 -17.33 64.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.281 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . 0.403 ' CG1' ' OE2' ' A' ' 275' ' ' GLU . 81.3 t -63.81 -43.3 97.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.803 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 284' ' ' SER . . . . . 0.434 ' O ' ' HG2' ' A' ' 287' ' ' ARG . 5.8 t -59.22 -45.72 90.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.156 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -69.63 -43.85 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 4.4 p -61.27 -48.6 80.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.932 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 284' ' ' SER . 34.9 ptt180 -65.58 -34.88 79.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 110.467 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.24 -65.1 0.7 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.092 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . 0.433 ' HZ2' HD21 ' A' ' 292' ' ' LEU . 25.6 mmtt -63.04 -39.21 94.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.824 -0.75 . . . . 0.0 109.961 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -43.94 -55.78 4.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.076 0.465 . . . . 0.0 110.051 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.24 79.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.883 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . 0.433 HD21 ' HZ2' ' A' ' 289' ' ' LYS . 18.1 tp -59.78 -53.21 60.63 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.838 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.21 -42.26 96.68 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.253 0.549 . . . . 0.0 110.31 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.504 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.0 tt0 -61.93 -37.68 85.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.786 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.48 -43.67 97.83 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -59.45 -44.44 92.97 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.356 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.504 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 44.8 p -59.17 -44.61 92.16 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.654 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . 0.468 ' N ' ' HG1' ' A' ' 297' ' ' THR . 39.7 ttmt -62.36 -45.32 93.7 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.638 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.79 -38.88 89.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.202 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.26 96.71 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.35 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.69 -42.71 98.04 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -61.3 -44.23 97.56 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.995 0.426 . . . . 0.0 110.573 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.8 m -60.44 -43.92 96.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.656 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.83 -43.38 91.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -57.8 -51.78 68.19 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.824 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -63.61 -40.92 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.462 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -63.62 -36.42 83.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.929 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 7.8 mt -62.02 -44.38 96.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.614 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.4 -47.81 69.22 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.943 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.46 -48.14 82.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.2 -39.45 94.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.576 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.2 t -58.93 -44.42 91.37 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.15 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . 0.495 ' O ' ' OG ' ' A' ' 316' ' ' SER . . . -67.63 -41.75 89.1 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 317' ' ' ARG . 94.3 mtt-85 -64.41 -45.13 88.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.917 0.389 . . . . 0.0 111.233 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.9 mm -72.52 -18.03 18.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.712 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.495 ' OG ' ' O ' ' A' ' 313' ' ' GLY . 71.8 p -50.49 -34.82 26.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.49 ' N ' ' HG ' ' A' ' 316' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 178.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.802 0.334 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.5 ptt85 -91.29 -6.4 53.22 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.548 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.506 ' SD ' ' NZ ' ' A' ' 24' ' ' LYS . 3.6 mmt -137.45 144.46 42.33 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.767 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.692 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 46.6 tp10 -66.13 -53.12 41.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.465 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.506 ' NZ ' ' SD ' ' A' ' 22' ' ' MET . 8.0 pttm -51.58 -43.74 62.55 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.239 0.542 . . . . 0.0 110.322 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.2 tp -61.62 -42.95 99.61 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.386 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.723 ' OD1' ' N ' ' A' ' 27' ' ' GLN . 1.5 p-10 -65.25 -25.35 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.234 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.723 ' N ' ' OD1' ' A' ' 26' ' ' ASN . 92.2 mt-30 -69.47 -45.62 68.58 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.921 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.83 -41.68 98.09 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.387 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.495 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 41.2 t-105 -61.82 -46.04 91.22 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.342 0.592 . . . . 0.0 110.399 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -57.86 -41.31 82.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.182 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -60.91 -41.76 96.75 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.183 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.93 86.85 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.205 0.526 . . . . 0.0 110.415 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.495 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 75.0 mt-30 -58.29 -39.12 78.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.241 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -62.78 -41.54 99.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.511 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.13 -34.84 77.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.262 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.57 107.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.869 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.2 mt -129.05 154.54 80.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.572 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -41.63 153.32 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.529 2.153 . . . . 0.0 112.206 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -57.2 -47.31 23.14 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.724 2.283 . . . . 0.0 112.327 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 69.5 t -64.29 -47.19 90.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.667 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -63.2 -41.87 99.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.389 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.0 tt -62.3 -43.01 99.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.629 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.5 -41.2 96.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.453 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -69.92 -42.54 73.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.496 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.97 -48.88 78.37 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -61.84 -40.54 95.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.21 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.43 -47.0 87.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.6 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.926 ' O ' HG22 ' A' ' 51' ' ' ILE . 50.3 t0 -59.43 -49.84 76.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.119 0.485 . . . . 0.0 110.293 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.63 -41.4 99.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.1 0.476 . . . . 0.0 110.441 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.26 -47.45 85.95 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.35 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.926 HG22 ' O ' ' A' ' 48' ' ' ASP . 16.9 tt -59.51 -36.82 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.404 HE22 HD22 ' A' ' 81' ' ' LEU . 52.2 tt0 -60.96 -42.42 98.26 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -61.07 -40.29 93.09 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.85 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -62.92 -44.29 96.48 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.728 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -60.98 -41.28 96.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.485 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -57.78 -48.49 79.54 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.005 0.431 . . . . 0.0 110.186 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.3 tp -59.99 -41.43 92.02 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.11 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.13 93.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.299 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.6 t90 -58.34 -44.97 88.95 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.067 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.58 -46.22 91.04 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.54 -41.87 86.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.181 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.12 -40.04 96.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.962 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.72 -42.98 84.91 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 39.4 mt . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.103 179.123 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -58.95 -36.18 74.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.359 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 73' ' ' LYS . 13.6 mptt -56.65 -68.58 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.099 0.476 . . . . 0.0 109.958 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -46.04 -38.95 8.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.16 94.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.559 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -63.64 -38.96 93.09 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 mp -64.32 -45.07 89.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.11 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.07 -45.91 95.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.177 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.2 ttt-85 -59.57 -43.85 93.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.112 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -62.63 -39.74 94.78 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.112 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.466 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.22 -50.92 71.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.285 0.564 . . . . 0.0 110.239 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.409 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 30.0 t-20 -64.97 -37.32 87.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.699 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 73.2 t -63.27 -45.88 97.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.393 -179.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.405 HD13 HG22 ' A' ' 84' ' ' ILE . 96.6 mt -61.16 -49.98 82.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.507 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.449 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.6 mm? -66.55 -42.02 87.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.019 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.24 94.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.06 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -62.38 -47.9 82.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.855 -179.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.08 -26.6 68.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.265 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.19 8.12 78.95 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.969 -0.853 . . . . 0.0 110.969 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.5 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-O 120.827 0.346 . . . . 0.0 110.557 179.637 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 C--O 1.239 0.501 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.629 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 94.7 mt-10 -62.4 -28.69 69.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.505 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.542 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 11.2 mmmt -60.96 -46.62 90.0 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.574 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.35 -46.79 66.17 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 120.948 0.404 . . . . 0.0 111.796 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.415 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 11.9 t-105 -59.25 -47.08 86.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.605 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.629 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.1 m-70 -69.73 -34.22 73.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.615 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.542 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 10.6 tptt -57.92 -52.0 67.32 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.178 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.818 ' O ' ' O ' ' A' ' 128' ' ' GLY . . . -73.61 -46.7 45.44 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.523 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -50.09 -39.79 43.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.669 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.483 ' C ' ' H ' ' A' ' 128' ' ' GLY . 20.8 m -97.69 -66.67 0.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.708 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 m -55.74 -7.0 0.24 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.419 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 1.153 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -160.25 98.38 0.17 Allowed Glycine 0 C--O 1.226 -0.373 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.421 ' C ' ' H ' ' A' ' 131' ' ' SER . 72.8 mmtt -41.98 44.78 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.355 0.598 . . . . 0.0 109.928 -179.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 1.153 ' N ' ' O ' ' A' ' 128' ' ' GLY . 3.4 m-30 -81.05 32.09 0.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.385 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.421 ' H ' ' C ' ' A' ' 129' ' ' LYS . 6.2 m -85.13 128.45 34.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.008 0.432 . . . . 0.0 111.533 -179.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.45 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . 111.3 -98.17 1.01 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.356 177.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 74.7 mm-40 -79.17 -43.85 23.11 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.991 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 57.1 mp0 -62.44 -50.49 71.28 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.076 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 130' ' ' PHE . 2.7 mt -61.09 -42.09 97.87 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.363 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.45 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 96.2 m-20 -63.3 -37.71 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.936 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 23.1 mmtp -62.26 -44.25 96.97 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-O 121.266 0.555 . . . . 0.0 109.991 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.441 HD21 ' O ' ' A' ' 134' ' ' GLU . 3.2 mm? -60.21 -43.47 95.93 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.247 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.481 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -65.21 -36.64 84.79 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.058 176.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.607 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 86.5 mtt180 -53.53 -43.79 68.66 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -70.12 -38.37 75.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.76 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.481 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.1 m-85 -59.35 -58.54 8.16 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.59 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 67.0 mt -60.79 -38.84 86.7 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.022 -0.671 . . . . 0.0 110.26 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.607 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 61.3 m170 -53.15 -43.98 67.45 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.096 -0.642 . . . . 0.0 109.706 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.4 ' HD1' HG23 ' A' ' 197' ' ' ILE . 3.3 m-70 -64.09 -39.52 94.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.658 178.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -61.75 -44.46 96.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.33 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -68.26 -51.2 47.79 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.698 0.285 . . . . 0.0 111.516 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -61.58 -43.42 98.9 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.954 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 26.1 t -62.49 -43.36 98.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.021 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.606 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -63.21 -38.51 91.45 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.67 -47.68 84.26 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.279 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.46 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 23.0 m-85 -65.8 -46.62 77.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.551 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.82 79.89 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.504 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.606 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 77.9 t -63.31 -45.48 98.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.031 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.2 mt . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.519 179.767 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 . . . . . 0 C--O 1.232 0.168 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.573 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 7.1 mt -62.47 -43.35 99.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.866 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.6 mttm -70.67 -32.72 70.08 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.602 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.4 tt0 -68.42 -45.89 71.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.183 -178.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.573 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 7.8 ptmt -73.47 -44.61 57.62 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.498 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.562 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -65.18 -41.72 94.34 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.887 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.519 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -68.32 -36.58 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.819 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.422 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 63.8 m -61.45 -40.93 96.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 193' ' ' LYS . 96.6 mt -63.53 -43.95 98.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.518 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.8 -42.25 97.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -63.97 -37.39 87.24 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.568 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.98 -43.15 99.79 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 17.5 mt -64.06 -42.26 97.06 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.201 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.69 -38.38 90.19 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.778 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . 0.565 ' O ' HG11 ' A' ' 207' ' ' VAL . 31.7 mt -61.0 -39.01 88.07 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.413 179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 83.3 mtt-85 -64.12 -41.62 97.16 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.19 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.54 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.6 mtp180 -64.82 -42.85 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.769 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.565 HG11 ' O ' ' A' ' 204' ' ' LEU . 0.3 OUTLIER -63.77 -37.42 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.44 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.474 ' N ' HG11 ' A' ' 207' ' ' VAL . 25.4 m -75.96 -26.92 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.575 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -98.29 -15.08 19.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.033 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 206' ' ' ARG . 52.4 mt-30 -129.53 -39.07 1.5 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.696 -179.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.549 0 N-CA-C 111.392 -0.683 . . . . 0.0 111.392 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 . . . . . 0 N--CA 1.441 -0.889 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -145.18 154.5 54.14 Favored Pre-proline 0 C--N 1.326 -0.431 0 C-N-CA 119.165 -1.014 . . . . 0.0 110.479 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.73 13.99 0.88 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.663 2.242 . . . . 0.0 112.147 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -124.58 -40.98 2.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.02 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.83 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 5.8 p -61.47 -78.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.246 0.916 0 CA-C-O 121.42 0.629 . . . . 0.0 110.869 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.83 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 1.1 mp -58.05 -25.54 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.45 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -63.24 -46.91 84.71 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.205 0.526 . . . . 0.0 109.844 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 24.5 mt -61.48 -40.99 96.53 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.677 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.0 m0 -61.39 -35.58 77.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.953 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -64.86 -37.28 87.1 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.735 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.6 mt -63.41 -41.27 98.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.968 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -60.03 20.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.0 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.735 ' H ' ' C ' ' A' ' 229' ' ' LEU . 13.8 tt0 -94.26 -44.82 7.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.668 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.2 p -121.03 -0.69 9.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.622 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.33 -103.52 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.587 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -141.53 95.39 2.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.505 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 3.8 mp -137.84 160.26 39.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.95 0.405 . . . . 0.0 110.562 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 33.9 p -85.44 -157.41 0.32 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.586 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' A' ' 238' ' ' LYS . 27.4 p-10 -96.34 -59.33 1.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.629 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . 0.498 ' H ' ' CG ' ' A' ' 237' ' ' ASP . 54.4 mtmt -62.25 -44.03 97.48 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 110.697 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -60.33 -32.0 70.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.163 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -43.24 96.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.189 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -63.73 -49.5 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.16 -38.23 85.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.042 0.449 . . . . 0.0 110.092 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.531 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.3 OUTLIER -68.21 -41.74 80.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.01 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -58.6 -52.25 66.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.96 0.41 . . . . 0.0 110.197 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.7 -42.27 95.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.577 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -56.5 -48.12 77.86 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.416 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.546 ' N ' HD21 ' A' ' 247' ' ' LEU . 1.4 mm? -63.49 -38.38 90.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.484 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.779 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 78.7 tttt -56.56 -44.81 81.29 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.347 0.594 . . . . 0.0 110.296 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -67.62 -38.57 84.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.488 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.35 -49.24 78.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.779 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.1 OUTLIER -60.5 -39.89 89.4 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.237 0.542 . . . . 0.0 109.873 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . 0.521 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.08 -36.86 84.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.266 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -62.37 -49.88 73.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.144 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.448 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.9 tt -61.91 -36.0 71.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.362 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -62.98 -45.9 90.26 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.166 0.508 . . . . 0.0 110.349 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -63.16 -44.77 94.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.536 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -55.96 -43.49 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.163 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -62.07 -40.97 97.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.19 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . 0.519 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 80.2 t60 -58.76 -48.21 82.02 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.413 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -63.52 -33.44 75.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.544 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.456 HE21 ' HB ' ' A' ' 297' ' ' THR . 64.3 mm-40 -61.63 -47.71 84.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.214 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . 0.411 ' HZ1' HD11 ' A' ' 266' ' ' ILE . 64.6 tttm -61.43 -46.25 90.87 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.051 0.453 . . . . 0.0 110.061 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . 0.519 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.6 mp0 -64.7 -35.18 80.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.242 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.82 -42.59 99.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.06 -46.24 85.23 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.467 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . 0.411 HD11 ' HZ1' ' A' ' 262' ' ' LYS . 87.1 mt -62.64 -43.37 98.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.346 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -63.26 -36.89 85.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.252 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -61.64 -47.73 84.05 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.332 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -64.54 -43.52 93.7 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.628 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.49 -43.09 99.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.518 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . 0.411 HD21 ' O ' ' A' ' 271' ' ' LEU . 6.1 tt -60.85 -44.38 97.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.322 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.97 -43.9 91.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.281 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -69.07 -47.32 65.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.663 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . 0.441 ' O ' ' CG2' ' A' ' 277' ' ' VAL . . . -60.43 -24.63 65.34 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.492 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -84.46 -1.74 56.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.476 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 42.2 m -120.06 -3.14 10.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.707 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.441 ' CG2' ' O ' ' A' ' 274' ' ' ALA . 16.8 m -63.33 -42.66 97.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.499 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 139.03 -82.9 0.25 Allowed Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.88 139.06 58.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.757 0.313 . . . . 0.0 110.402 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -107.41 116.44 4.92 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -145.49 -45.12 0.21 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.488 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -98.7 0.64 45.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.553 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.97 -48.29 88.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.538 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.5 t -63.36 -46.84 84.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.907 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.6 -41.65 96.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.739 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.0 t -62.47 -44.07 97.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -63.43 -41.61 98.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.498 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -60.34 -52.33 65.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.278 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -65.77 -33.42 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.135 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -56.45 -48.05 77.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.155 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.22 -40.44 71.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.968 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 3.5 tp -61.81 -50.67 71.39 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.26 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 23.9 tp -63.63 -41.48 98.25 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.4 tt0 -62.73 -37.72 87.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.022 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 299' ' ' GLU . . . -64.01 -47.03 89.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . 0.405 ' O ' ' HD2' ' A' ' 296' ' ' ARG . 15.4 tpt85 -57.82 -44.16 86.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.474 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 12.2 p -60.36 -48.1 83.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.346 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 295' ' ' GLY . 90.3 mt-10 -57.95 -55.33 36.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.592 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . 0.405 HD22 HH12 ' A' ' 296' ' ' ARG . 12.9 tp -61.56 -45.03 95.87 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.465 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -47.43 -47.02 22.88 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.084 -1.206 . . . . 0.0 110.084 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -65.48 -37.15 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.929 0.395 . . . . 0.0 109.967 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 20.0 m -60.47 -47.4 86.29 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.3 t -61.36 -46.13 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.376 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.41 -46.78 88.69 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.044 0.449 . . . . 0.0 110.284 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -58.56 -50.18 74.72 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.424 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.55 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.4 OUTLIER -65.07 -30.34 71.29 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.99 178.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . 0.431 ' O ' ' CB ' ' A' ' 312' ' ' SER . 1.4 tp -58.53 -46.58 86.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.056 -178.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -76.15 -54.49 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.813 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . 0.415 ' C ' ' OD1' ' A' ' 310' ' ' ASP . 61.6 t0 -58.96 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . 0.55 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 3.4 tp -61.67 -39.79 92.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.512 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 312' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 10.4 t -58.73 -43.56 90.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.665 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . 0.464 ' O ' ' OG ' ' A' ' 316' ' ' SER . . . -66.17 -40.12 94.8 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 317' ' ' ARG . 77.5 mtp180 -61.7 -43.46 98.82 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-O 120.693 0.282 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.7 -42.48 95.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.792 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.464 ' OG ' ' O ' ' A' ' 313' ' ' GLY . 83.6 p -49.67 -39.77 37.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.224 0.535 . . . . 0.0 109.649 -179.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 314' ' ' ARG . 22.4 tpp85 . . . . . 0 CA--C 1.513 -0.465 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.643 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 C--O 1.235 0.3 0 CA-C-O 120.669 0.271 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -88.68 2.39 53.37 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.723 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.436 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 3.7 mmt -143.11 140.06 30.71 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.375 0.607 . . . . 0.0 110.824 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.22 -36.26 81.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.306 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -56.5 -47.08 80.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.131 0.491 . . . . 0.0 110.542 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 99.3 mt -61.47 -40.17 93.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.856 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.436 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.5 m-80 -63.94 -37.4 87.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.169 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -60.39 -48.66 80.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.297 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.429 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 4.0 mm? -61.23 -42.38 98.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.205 179.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.509 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 34.1 t-105 -62.18 -44.53 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.229 0.538 . . . . 0.0 110.387 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -57.03 -44.96 83.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.246 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.6 -42.82 97.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.424 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.27 -41.85 80.5 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.218 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.509 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.2 mt-30 -64.7 -37.67 88.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.192 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -60.09 -43.62 95.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.449 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.39 -39.46 92.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.596 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.45 110.72 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.849 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -131.46 154.16 81.81 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.62 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -43.28 154.32 0.18 Allowed 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.618 2.212 . . . . 0.0 112.193 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.51 -42.04 69.74 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.582 2.188 . . . . 0.0 112.191 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.15 -49.71 82.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.551 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -66.47 -41.35 89.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 tp -64.26 -40.18 95.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.434 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -65.15 -38.86 91.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.466 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.37 -50.11 72.85 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.398 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -61.2 -39.97 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.444 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.94 92.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.425 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -60.56 -50.17 74.61 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.366 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.04 -39.3 94.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.383 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -56.55 -46.91 80.43 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.215 0.531 . . . . 0.0 110.142 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.7 mt -62.31 -42.73 96.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.761 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -51.51 -42.81 61.98 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -64.42 -41.26 96.7 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -61.4 -44.45 97.13 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.629 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -61.22 -41.62 97.17 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.373 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -54.75 -46.74 74.37 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.149 0.499 . . . . 0.0 110.062 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 23.8 mt -61.72 -41.4 97.57 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.334 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.94 -46.33 88.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.647 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.5 t90 -58.99 -39.9 83.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.342 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -59.89 -46.06 90.53 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.08 -41.51 92.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.114 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.36 -40.5 94.51 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.956 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.37 -43.3 96.69 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 51.5 tp . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.889 179.714 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.753 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -56.94 -36.63 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.863 0.363 . . . . 0.0 110.32 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -58.86 -64.78 0.81 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.853 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -44.87 -42.73 8.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.209 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.11 84.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.214 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -62.04 -41.58 98.27 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.86 -43.65 98.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.957 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.36 -47.72 90.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.106 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.7 mtt-85 -59.51 -43.35 93.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.924 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 84' ' ' ILE . 93.2 m-20 -64.33 -41.26 96.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.389 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.3 -48.33 71.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.008 0.432 . . . . 0.0 110.253 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -66.77 -36.48 82.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.366 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 75.1 t -63.85 -47.95 88.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.539 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 80' ' ' ASN . 48.6 mt -61.26 -50.34 80.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.631 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.22 -41.79 94.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.918 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.68 80.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.72 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.29 -44.77 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.844 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -59.47 -34.27 72.35 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.098 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 88.79 17.76 55.86 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--O 1.223 -0.322 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.412 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 N--CA 1.461 0.094 0 CA-C-O 120.836 0.35 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.542 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 68.0 mt-10 -58.5 -33.35 69.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.811 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 52.7 mtpt -61.09 -48.35 82.11 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.901 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 13.5 mt -70.57 -46.83 62.75 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.966 0.412 . . . . 0.0 111.939 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.427 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 9.8 t-105 -59.38 -49.54 77.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.456 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.542 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.0 m-70 -71.16 -32.85 69.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.661 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.759 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 11.6 tptt -55.43 -51.65 66.19 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.949 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.09 -46.79 49.42 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.885 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -50.97 -48.75 61.03 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.969 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 12.4 m -83.91 -41.15 17.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.872 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.597 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 8.8 t -46.48 -26.1 0.8 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.296 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -159.09 -94.51 0.1 Allowed Glycine 0 N--CA 1.464 0.536 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.363 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' ' 131' ' ' SER . 13.2 pttp -161.52 24.08 0.12 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.96 44.74 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.318 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.56 ' H ' ' C ' ' A' ' 129' ' ' LYS . 6.1 p -103.44 136.42 43.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.083 0.468 . . . . 0.0 111.288 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 97.89 -97.1 1.89 Allowed Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.173 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 94.7 mt-10 -75.11 -43.81 50.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.806 0.336 . . . . 0.0 111.116 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.559 ' O ' HD23 ' A' ' 138' ' ' LEU . 53.3 mp0 -61.82 -54.38 43.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.421 HD21 ' CD2' ' A' ' 121' ' ' TRP . 1.8 mt -59.63 -40.51 87.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.323 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -60.77 -44.11 97.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 61.3 mttp -60.55 -44.17 96.42 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.559 HD23 ' O ' ' A' ' 134' ' ' GLU . 4.5 mm? -57.79 -39.11 76.76 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -73.28 -29.43 62.73 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.344 -0.843 . . . . 0.0 113.08 177.174 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.512 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 95.3 mtt-85 -57.38 -46.49 83.36 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.097 -1.041 . . . . 0.0 108.243 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . 0.484 ' H ' ' HG2' ' A' ' 141' ' ' GLU . 6.1 pt-20 -72.71 -37.65 67.73 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.733 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.577 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.9 m-85 -55.75 -57.26 12.76 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.393 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.773 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 48.6 mt -61.75 -39.22 90.84 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.043 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.512 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 63.4 m170 -54.54 -41.02 69.25 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.758 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -65.28 -45.88 82.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.193 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.773 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 45.4 pttt -59.65 -44.43 93.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.175 -178.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.545 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 74.1 mm-40 -68.24 -48.88 63.94 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.542 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -60.99 -44.21 97.74 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.856 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.84 -45.36 99.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.112 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.587 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.3 m170 -64.59 -34.29 77.91 Favored 'General case' 0 C--O 1.216 -0.699 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.362 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -64.65 -48.04 76.27 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.229 -0.589 . . . . 0.0 110.502 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.424 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 37.2 m-85 -63.95 -46.37 85.01 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.566 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -69.1 -45.18 70.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.837 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.587 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 71.2 t -64.79 -43.73 96.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.342 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 C--O 1.238 0.5 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.373 -179.13 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 . . . . . 0 C--O 1.238 0.493 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.47 ' N ' HD12 ' A' ' 190' ' ' LEU . 8.8 mp -61.78 -38.55 88.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.225 178.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.496 ' O ' ' HB3' ' A' ' 195' ' ' ARG . 97.9 mttt -67.67 -32.48 73.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.388 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 97.3 mt-10 -67.85 -50.12 58.33 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.023 0.44 . . . . 0.0 111.386 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.48 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 ptmt -71.55 -41.76 68.71 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.373 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.546 ' HG ' ' N ' ' A' ' 195' ' ' ARG . 0.3 OUTLIER -70.29 -41.72 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.841 -179.361 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.546 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 14.6 ptm180 -63.46 -39.13 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.7 -41.72 97.98 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 193' ' ' LYS . 85.2 mt -64.2 -43.32 97.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.561 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.475 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.5 m-20 -62.59 -40.86 98.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.247 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.524 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 1.3 mp0 -60.55 -39.17 86.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -62.94 -37.96 95.79 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 21.6 mt -63.19 -41.12 99.15 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.717 178.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.543 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.5 OUTLIER -64.2 -35.97 82.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.482 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.5 tmt_? -64.25 -41.15 97.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.915 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.9 mt -61.58 -40.25 94.07 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -61.69 -42.86 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.897 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.581 ' O ' ' HG2' ' A' ' 210' ' ' GLN . 73.5 mtp85 -62.7 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.676 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -62.55 -36.6 75.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.408 ' N ' HG11 ' A' ' 207' ' ' VAL . 75.4 p -77.37 -26.08 51.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.094 179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -95.05 -12.98 25.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.884 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.581 ' HG2' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -131.82 -37.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.303 -179.136 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.629 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.527 0.825 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 120.641 0.258 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -45.91 161.54 0.26 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.88 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -71.29 111.13 3.02 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.527 2.151 . . . . 0.0 112.45 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -170.32 -84.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.845 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.572 ' CG2' ' N ' ' A' ' 224' ' ' ILE . 2.7 m -61.87 -49.74 83.01 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 CA-C-O 121.506 0.67 . . . . 0.0 110.575 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.572 ' N ' ' CG2' ' A' ' 223' ' ' VAL . 0.4 OUTLIER -67.25 -26.51 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -66.99 -42.48 84.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.417 0.627 . . . . 0.0 109.318 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.0 tp -61.08 -42.05 97.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.171 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 48.2 m0 -60.62 -37.76 82.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.848 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -60.7 -39.47 88.66 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.455 ' O ' ' N ' ' A' ' 233' ' ' ALA . 92.8 mt -62.44 -42.25 99.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.947 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -41.19 -32.44 0.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.855 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -68.95 -67.83 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.657 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 91.0 p -66.23 -18.87 65.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.495 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . 0.455 ' N ' ' O ' ' A' ' 229' ' ' LEU . . . -55.25 -106.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.653 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -155.83 105.03 2.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 70.9 mt -146.68 168.59 20.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.715 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 69.4 p -80.12 164.43 23.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -63.39 -49.4 73.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.99 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.18 -44.84 94.29 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.566 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -62.95 -36.18 82.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.027 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . 0.444 HD12 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.33 -44.05 96.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.985 0.422 . . . . 0.0 110.44 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.64 -55.02 30.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.506 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.36 77.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.065 0.46 . . . . 0.0 110.402 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.418 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.04 -43.8 98.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.283 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -54.14 -54.21 42.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.045 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -62.54 -39.08 92.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.282 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -56.86 -51.96 67.01 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.233 0.54 . . . . 0.0 110.45 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.563 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.2 mm? -63.42 -36.86 85.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.772 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.439 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 88.7 tttt -55.94 -48.46 75.7 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.303 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -66.64 -39.56 88.32 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -62.28 -48.96 77.6 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.005 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.6 pt-20 -61.47 -35.07 76.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.231 0.538 . . . . 0.0 109.644 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.05 83.06 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.282 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -61.03 -46.59 90.09 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.725 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.505 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.5 tp -63.67 -37.09 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.218 -0.447 . . . . 0.0 109.891 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -56.61 -51.43 68.67 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.036 0.446 . . . . 0.0 109.87 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -61.99 -42.65 99.38 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -55.37 -44.31 75.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.199 0.523 . . . . 0.0 110.199 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -62.12 -40.15 94.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.024 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -57.8 -46.33 84.8 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.117 0.484 . . . . 0.0 110.514 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -63.69 -36.36 83.59 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.483 HE21 ' CG2' ' A' ' 297' ' ' THR . 75.3 mm-40 -58.88 -48.33 81.8 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.03 -44.88 94.33 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -63.34 -37.54 87.68 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.082 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.74 -41.86 97.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.37 -48.13 82.66 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.39 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 63.6 mt -62.15 -42.82 96.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.333 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.65 -36.91 82.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.349 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -63.34 -46.41 86.69 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.091 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.28 -45.72 92.35 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.135 0.493 . . . . 0.0 110.604 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.66 -37.77 85.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.42 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.22 -43.8 98.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.23 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -61.33 -43.24 99.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.309 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . 0.516 ' O ' ' OG ' ' A' ' 276' ' ' SER . 78.2 m80 -69.49 -40.15 77.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.756 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . 0.449 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -62.6 -38.3 89.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.4 -24.43 67.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.667 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 276' ' ' SER . . . . . 0.516 ' OG ' ' O ' ' A' ' 273' ' ' HIS . 78.7 p -78.59 -5.84 53.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.637 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.449 ' CG1' ' O ' ' A' ' 274' ' ' ALA . 10.6 p -60.1 -30.13 45.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.444 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 102.42 -72.04 0.32 Allowed Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -65.01 139.09 58.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.779 0.324 . . . . 0.0 110.544 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -92.01 126.77 8.64 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -166.11 -78.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.821 0.343 . . . . 0.0 110.482 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -72.75 -6.63 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 54.7 t -64.2 -45.17 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.533 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 1.1 p -62.2 -44.87 95.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.848 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -62.15 -44.28 96.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 t -60.86 -45.39 94.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.537 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -63.57 -35.29 80.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.417 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -60.8 -61.95 2.21 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.23 0.538 . . . . 0.0 110.363 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 11.4 mmtm -62.01 -35.4 78.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.116 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -51.27 -48.42 62.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.879 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.07 76.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 17.0 tp -62.06 -52.4 64.06 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.55 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . 0.425 ' N ' HD12 ' A' ' 293' ' ' LEU . 8.8 mp -63.47 -42.59 98.59 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.196 0.522 . . . . 0.0 110.097 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.598 ' O ' ' OG1' ' A' ' 297' ' ' THR . 83.2 tt0 -63.28 -36.37 83.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.817 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.21 -44.13 97.54 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -60.12 -43.11 95.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.468 . . . . 0.0 110.176 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.598 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 19.9 p -58.34 -43.36 88.24 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -39.85 95.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.358 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -58.41 -49.2 78.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.329 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.35 -43.55 96.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.512 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.27 -42.57 82.87 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -63.65 -47.14 82.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.054 0.454 . . . . 0.0 110.655 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 303' ' ' THR . . . . . 0.402 HG23 ' ND1' ' A' ' 307' ' ' HIS . 10.8 m -61.5 -43.78 98.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.723 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.39 -41.82 88.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -60.19 -50.38 73.89 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-O 121.153 0.501 . . . . 0.0 110.535 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -63.04 -39.98 96.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.459 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.402 ' ND1' HG23 ' A' ' 303' ' ' THR . 3.4 m170 -66.69 -33.65 76.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.997 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 3.9 mt -61.81 -46.12 90.89 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.661 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -68.31 -41.89 80.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.52 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.07 -47.17 84.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.886 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 26.8 mt -62.05 -43.2 99.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.964 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 78.4 p -62.74 -36.63 83.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.511 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.27 -45.04 83.84 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . 0.485 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.85 -43.0 97.44 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.029 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . 0.45 HD12 HG23 ' A' ' 315' ' ' ILE . 55.8 mt -86.55 -2.62 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.739 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 46.9 t -59.15 -44.3 92.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.299 0.571 . . . . 0.0 109.464 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.5 ptp85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.233 -0.894 . . . . 0.0 108.866 178.961 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 . . . . . 0 C--O 1.234 0.277 0 CA-C-O 120.676 0.274 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.513 ' C ' ' SD ' ' A' ' 22' ' ' MET . 87.7 mtm180 -93.8 8.61 40.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.734 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.513 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -136.21 133.88 37.55 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.263 0.554 . . . . 0.0 110.711 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.495 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 58.4 mp0 -65.72 -35.91 82.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.594 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.407 ' O ' HD22 ' A' ' 28' ' ' LEU . 64.8 mttp -58.65 -49.38 77.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.102 0.477 . . . . 0.0 110.506 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.89 -34.85 78.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.756 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -66.36 -40.67 89.93 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.54 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -62.97 -45.97 89.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.596 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.4 mm? -61.88 -41.55 98.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.562 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.425 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 55.6 t-105 -62.29 -45.94 91.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.12 0.486 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.62 -45.26 89.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.694 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.24 -41.65 97.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.478 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.34 -41.7 97.48 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.746 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 99.2 mt-30 -61.89 -39.29 91.43 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.076 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.475 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 85.5 mmt-85 -64.47 -38.99 92.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.601 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.7 -39.18 93.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.752 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.746 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 28.6 m80 66.21 106.58 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.818 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.448 ' CD2' ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -132.21 155.8 80.86 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.51 179.844 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -42.31 153.38 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.545 2.163 . . . . 0.0 112.364 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -59.3 -40.54 67.34 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.734 2.29 . . . . 0.0 112.23 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 79.1 t -62.07 -47.08 94.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.548 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttm-85 -65.8 -42.13 91.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.539 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.5 tp -63.6 -45.16 91.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.69 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.77 -46.68 86.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.55 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -66.63 -42.52 86.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.421 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.401 ' O ' ' CD1' ' A' ' 49' ' ' LEU . 59.0 tp -63.53 -51.2 66.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.848 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -58.07 -41.96 84.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.481 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.555 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.84 -47.31 86.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.544 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -56.18 -47.36 78.46 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.458 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.401 ' CD1' ' O ' ' A' ' 45' ' ' LEU . 6.9 mp -59.63 -40.29 87.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.035 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -58.85 -38.36 78.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 47' ' ' ALA . 28.3 mm -63.66 -42.52 96.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.785 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -57.72 -47.2 83.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.542 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -59.8 -50.51 73.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.26 0.552 . . . . 0.0 110.227 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 54' ' ' ARG . 71.3 mmt-85 -62.03 -41.0 97.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.564 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.413 ' O ' ' OD1' ' A' ' 55' ' ' ASP . 66.5 t0 -62.7 -39.28 93.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.543 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -60.03 -47.69 84.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.989 0.423 . . . . 0.0 110.152 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.75 -41.24 97.42 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.366 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.39 98.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.47 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.464 ' CH2' ' HD2' ' A' ' 63' ' ' LYS . 86.5 t90 -60.77 -41.28 95.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.343 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -61.3 -46.93 88.25 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -62.62 -43.14 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.406 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.5 mt -62.18 -41.49 98.37 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.146 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.464 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 88.6 tttt -60.69 -42.05 96.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 179.555 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.462 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.527 0.833 0 N-CA-C 111.014 -0.835 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -68.61 -34.87 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.761 0.315 . . . . 0.0 110.592 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -60.63 -60.74 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.967 0.413 . . . . 0.0 110.251 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 18.0 pt-20 -56.36 -42.09 77.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.135 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.449 ' HB1' HH12 ' A' ' 79' ' ' ARG . . . -60.25 -40.7 91.25 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.265 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -61.3 -40.83 95.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -63.5 -43.36 97.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.128 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.423 HD12 HG23 ' A' ' 78' ' ' ILE . 96.6 mt -62.79 -48.73 86.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.745 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.449 HH12 ' HB1' ' A' ' 75' ' ' ALA . 94.8 mtm-85 -60.91 -40.41 93.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.086 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.455 ' O ' HG13 ' A' ' 84' ' ' ILE . 7.2 t-20 -63.41 -37.98 89.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.375 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.434 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.7 -47.53 84.21 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.189 0.519 . . . . 0.0 109.847 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -65.45 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.616 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.79 -45.54 98.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.356 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.65 -48.39 87.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.268 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 85' ' ' LEU . 3.2 mm? -64.95 -41.03 95.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.965 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.23 98.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.655 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -62.54 -48.06 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.538 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -69.07 -23.44 64.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.295 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.25 22.55 75.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.5 mt . . . . . 0 C--N 1.33 -0.273 0 CA-C-O 120.776 0.322 . . . . 0.0 110.484 -179.893 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 8.3 mp . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.825 0.345 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.577 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.9 mt-10 -58.95 -33.31 70.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.478 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 66.6 mttm -61.25 -48.1 82.99 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.639 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 35.5 mt -66.75 -44.16 82.2 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.773 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.47 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 6.8 t-105 -59.22 -50.3 74.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.483 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.577 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.0 m-70 -67.8 -32.2 72.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.266 179.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 127' ' ' SER . 10.8 tptt -56.94 -51.45 69.12 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.82 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.453 ' O ' ' OG ' ' A' ' 127' ' ' SER . . . -69.82 -47.03 64.31 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.554 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -53.86 -50.23 66.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.482 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -73.95 -42.83 59.94 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.484 ' HB3' ' O ' ' A' ' 123' ' ' LYS . 80.0 p -44.38 -29.58 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.01 0.433 . . . . 0.0 109.917 -178.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -161.4 -96.74 0.11 Allowed Glycine 0 N--CA 1.463 0.44 0 C-N-CA 119.848 -1.168 . . . . 0.0 111.581 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.787 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -154.91 22.75 0.44 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.445 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.2 m-30 -56.36 49.13 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.644 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.787 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -105.82 121.14 43.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.215 -179.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 114.63 -97.08 0.8 Allowed Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.211 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -77.33 -43.93 31.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.784 0.326 . . . . 0.0 110.989 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.445 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 58.5 mp0 -61.64 -51.74 67.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.018 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.435 HD23 ' CE3' ' A' ' 121' ' ' TRP . 1.1 mt -62.14 -40.86 97.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.261 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.69 -43.31 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -60.53 -42.57 96.76 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-O 121.199 0.523 . . . . 0.0 110.138 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mt -58.32 -43.52 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -66.81 -35.24 79.62 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.934 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -54.05 -41.4 68.08 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.076 -1.049 . . . . 0.0 108.227 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -71.45 -41.73 69.08 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.753 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -59.39 -57.7 11.83 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.66 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 95.8 mt -60.16 -38.98 84.82 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.206 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -54.99 -46.14 75.1 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.028 -0.669 . . . . 0.0 109.54 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -60.88 -40.01 91.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.681 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.88 -44.47 97.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.456 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -70.18 -46.4 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.388 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.37 -47.04 85.92 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.05 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 37.3 t -64.56 -41.74 93.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.71 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.591 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -58.17 -44.31 87.9 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.327 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.56 -40.03 95.94 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.98 -50.28 69.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.954 0.406 . . . . 0.0 110.575 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -72.2 -43.75 64.03 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.591 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 78.9 t -60.3 -46.71 94.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.943 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 79.2 mt . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.708 179.354 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 . . . . . 0 CA--C 1.519 -0.215 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.533 ' CD2' ' HZ1' ' A' ' 193' ' ' LYS . 5.4 mt -62.91 -46.21 88.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -69.69 -42.14 74.51 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.281 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -68.83 -43.01 76.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.565 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.552 ' O ' ' OG ' ' A' ' 196' ' ' SER . 20.5 pttt -74.24 -44.15 54.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.508 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.523 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.36 -41.69 80.28 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.875 -179.629 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.521 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.1 ptm180 -66.24 -37.31 85.2 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.552 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 91.9 p -59.09 -40.0 83.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.64 -43.57 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.251 178.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -63.37 -41.02 98.8 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.636 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.44 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 95.8 mt-30 -61.11 -40.45 93.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.456 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.09 -41.26 97.99 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 19.7 mt -62.4 -41.09 98.4 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.059 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.585 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.3 OUTLIER -63.27 -36.05 82.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.541 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.5 tmm_? -63.46 -42.61 98.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.538 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 40.6 mt -62.15 -40.08 94.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.293 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.523 ' O ' ' ND1' ' A' ' 209' ' ' HIS . 74.4 mtp85 -62.39 -42.67 99.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.086 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.754 ' O ' ' N ' ' A' ' 210' ' ' GLN . 85.2 mtm180 -64.72 -39.32 93.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.183 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.528 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 41.3 t -64.75 -44.32 96.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.105 0.479 . . . . 0.0 110.521 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.6 m -73.93 -26.7 60.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.484 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . 0.523 ' ND1' ' O ' ' A' ' 205' ' ' ARG . 57.0 m80 -100.57 -26.18 13.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.176 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.754 ' N ' ' O ' ' A' ' 206' ' ' ARG . 7.2 tp-100 -119.7 -29.62 4.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.881 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.528 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.482 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.546 ' O ' ' C ' ' A' ' 220' ' ' GLU . 84.2 tt0 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.222 0.058 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.546 ' C ' ' O ' ' A' ' 219' ' ' GLU . 23.7 tt0 27.06 94.3 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.609 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -47.96 82.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.471 2.114 . . . . 0.0 112.132 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 220' ' ' GLU . 56.8 ttm-85 -162.24 -50.9 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.585 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.437 HG21 ' H ' ' A' ' 224' ' ' ILE . 0.0 OUTLIER -64.59 -71.96 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.607 0 CA-C-O 121.328 0.585 . . . . 0.0 110.832 -179.684 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.437 ' H ' HG21 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -60.01 -25.58 33.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.342 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.14 -43.97 85.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.35 0.595 . . . . 0.0 109.64 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.41 -41.97 97.98 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -61.71 -36.66 81.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.798 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.63 -37.45 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.214 0.531 . . . . 0.0 109.745 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.682 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.0 mt -64.39 -41.49 96.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.82 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 235' ' ' LEU . . . -58.54 10.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.868 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.682 ' H ' ' C ' ' A' ' 229' ' ' LEU . 2.8 pt20 -76.78 -47.44 21.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.703 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.43 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 76.8 p -129.66 9.52 5.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.644 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 234' ' ' ASN . . . -56.58 -49.6 74.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.578 -179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 233' ' ' ALA . 29.7 t30 173.66 74.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.636 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . 0.493 HD12 ' N ' ' A' ' 235' ' ' LEU . 0.7 OUTLIER -136.05 172.64 12.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 -179.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 43.2 p -94.07 167.02 11.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.72 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -62.52 -48.38 79.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.064 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.95 -45.0 95.58 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.43 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -62.5 -34.9 77.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.634 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -41.51 99.31 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.534 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -63.85 -51.42 64.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.69 98.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.1 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -64.04 -43.14 96.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.91 178.838 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -57.3 -51.19 70.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.358 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -66.51 -40.37 89.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.585 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -59.36 -51.04 71.65 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.402 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.464 HD22 ' O ' ' A' ' 243' ' ' PHE . 4.3 mm? -64.29 -37.04 86.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.563 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.669 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 33.6 ttpt -56.46 -43.8 79.92 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.192 0.52 . . . . 0.0 110.184 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -69.58 -42.71 74.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.488 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -61.93 -48.74 79.05 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.21 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.669 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 2.5 pp20? -60.27 -38.33 83.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.134 0.492 . . . . 0.0 109.905 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 251' ' ' GLU . . . -66.64 -36.59 82.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.366 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.23 -47.61 83.67 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.174 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.457 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.7 OUTLIER -65.1 -41.91 93.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.592 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -61.4 -46.73 88.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.319 0.58 . . . . 0.0 110.112 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.57 -41.72 98.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.332 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -55.02 -45.44 75.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.124 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -61.3 -42.94 99.5 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.15 0.5 . . . . 0.0 110.19 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.4 -41.18 96.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.166 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . 0.425 ' O ' ' N ' ' A' ' 264' ' ' LEU . 26.0 m-85 -63.65 -37.29 86.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.522 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.481 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 35.3 mm-40 -60.3 -52.02 67.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.229 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.69 -45.31 94.66 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.081 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -67.37 -30.44 70.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.277 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' A' ' 260' ' ' TYR . 46.4 tp -63.52 -45.4 90.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.047 0.451 . . . . 0.0 110.308 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.37 -47.63 69.84 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.519 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 97.6 mt -62.42 -43.06 97.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.943 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.056 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -59.56 -46.94 87.43 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.08 0.466 . . . . 0.0 110.193 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -62.6 -43.82 97.85 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.278 0.561 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.08 -39.51 90.18 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.327 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . 0.463 ' C ' ' CD2' ' A' ' 271' ' ' LEU . 7.4 tt -59.85 -43.83 94.44 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.3 ttt85 -58.45 -44.46 89.24 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.126 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -68.52 -40.2 80.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.567 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . 0.417 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -57.24 -44.21 83.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.692 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . 0.553 ' OE2' ' NH2' ' A' ' 287' ' ' ARG . 92.2 mt-10 -61.66 -22.28 65.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.494 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.5 t -91.85 5.84 48.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.626 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.424 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 14.5 p -62.44 -43.66 98.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.61 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.424 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 166.41 -111.83 0.47 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -61.53 -41.01 96.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.78 0.324 . . . . 0.0 110.563 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 281' ' ' GLU . . . 152.72 -111.69 0.5 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . 0.657 ' C ' ' H ' ' A' ' 283' ' ' VAL . 95.5 mt-10 58.9 152.66 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 281' ' ' GLU . 96.8 mtt180 64.26 -19.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . 0.657 ' H ' ' C ' ' A' ' 281' ' ' GLU . 8.9 p -67.91 -47.42 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.696 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 284' ' ' SER . . . . . 0.424 ' N ' ' CG1' ' A' ' 283' ' ' VAL . 42.1 m -63.41 -44.94 93.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.941 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -65.73 -43.53 88.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.833 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 59.1 m -61.11 -44.98 96.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.794 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . 0.553 ' NH2' ' OE2' ' A' ' 275' ' ' GLU . 94.8 mtt-85 -66.03 -39.61 90.34 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.189 0.519 . . . . 0.0 111.045 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.97 -59.21 5.82 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.073 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . 0.4 ' HA ' ' HB3' ' A' ' 292' ' ' LEU . 54.6 mmtt -63.41 -39.88 95.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.07 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -41.81 -57.78 2.24 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.382 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.37 80.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.717 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . 0.4 ' HB3' ' HA ' ' A' ' 289' ' ' LYS . 35.6 tp -60.65 -49.87 75.77 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.499 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . 0.444 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.8 mp -64.93 -41.63 95.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.978 0.418 . . . . 0.0 110.06 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -58.93 -45.35 90.59 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.182 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.28 -43.83 98.54 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -62.72 -38.87 92.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.419 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.481 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 1.5 m -60.75 -51.71 68.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.395 0.617 . . . . 0.0 110.076 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -65.3 -44.95 86.27 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.246 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -58.39 -38.01 76.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.987 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.72 -42.82 99.85 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.66 -46.19 93.68 Favored Glycine 0 CA--C 1.53 1.009 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.62 -43.51 93.75 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 110.45 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.8 m -60.26 -41.64 93.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.128 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.83 -43.86 89.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -57.6 -55.11 39.07 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.244 0.545 . . . . 0.0 110.619 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -62.73 -38.47 90.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.425 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -63.35 -38.01 89.51 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.279 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 6.8 mt -62.02 -44.56 96.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.343 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? -70.59 -43.2 69.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.704 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -63.34 -46.02 88.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.836 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 23.9 mt -63.43 -42.11 98.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.92 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 67.8 m -58.97 -44.29 91.5 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.362 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -71.04 -36.64 64.35 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -63.2 -43.89 96.91 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.732 0.301 . . . . 0.0 110.758 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . 0.591 ' O ' ' N ' ' A' ' 317' ' ' ARG . 2.3 mt -81.29 -97.16 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.904 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 315' ' ' ILE . 0.4 OUTLIER 35.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.095 0.474 . . . . 0.0 110.444 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.591 ' N ' ' O ' ' A' ' 315' ' ' ILE . 17.6 ptp180 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.465 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.74 0.305 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.3 mtt180 -94.4 16.45 15.14 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.901 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.581 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.5 mmt -142.29 133.9 26.75 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.113 0.482 . . . . 0.0 111.217 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -67.3 -43.99 80.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.539 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -60.01 -45.69 91.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.419 0.628 . . . . 0.0 110.5 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.3 tp -60.76 -38.77 86.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.402 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.581 ' ND2' ' O ' ' A' ' 22' ' ' MET . 49.6 m-80 -62.37 -39.29 92.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.814 179.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -57.59 -46.25 84.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.258 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -61.42 -43.2 99.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.095 0.474 . . . . 0.0 110.41 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.404 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 24.8 t-105 -60.91 -45.41 94.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.235 0.54 . . . . 0.0 110.595 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.41 -40.61 87.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.264 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -60.57 -43.3 97.44 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.255 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.99 97.17 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.284 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.541 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 77.3 mt-30 -58.16 -45.07 88.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.344 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.486 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 93.7 mtm-85 -65.65 -33.98 77.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.48 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.3 tp -62.09 -37.57 85.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.127 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.541 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 26.8 m80 65.94 109.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 mt -139.3 154.96 72.4 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.02 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 154.6 0.1 OUTLIER 'Trans proline' 0 C--N 1.312 -1.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.26 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.14 -34.7 16.02 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.461 2.108 . . . . 0.0 112.321 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.49 -48.91 81.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.617 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -69.94 -39.97 75.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.586 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.7 -43.89 95.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.586 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.09 -44.4 84.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.612 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -66.88 -45.73 77.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.643 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.1 tp -62.67 -47.91 81.61 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.534 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -59.03 -40.71 85.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.973 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.442 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.93 -45.13 93.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.812 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.07 -46.4 85.5 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.915 0.388 . . . . 0.0 110.409 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 40.6 mt -60.01 -40.84 90.65 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.128 0.489 . . . . 0.0 110.158 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -59.0 -39.64 82.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.059 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.4 mm -62.13 -43.8 98.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.648 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -55.74 -44.83 77.95 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.389 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -60.41 -46.73 88.94 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.261 0.553 . . . . 0.0 110.425 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.62 -43.34 93.84 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.7 -38.64 85.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.115 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -58.07 -47.32 83.52 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 16.0 mt -60.84 -42.6 98.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.391 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.09 99.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.5 t90 -57.6 -43.14 84.46 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.135 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.66 -45.87 92.19 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.03 0.443 . . . . 0.0 109.931 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.09 -44.45 91.91 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.5 HD22 ' HZ3' ' A' ' 73' ' ' LYS . 7.2 mp -62.72 -39.04 92.82 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.848 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.51 -44.55 76.73 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 30.6 mt . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.038 179.131 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.776 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -60.46 -33.97 73.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HZ3' HD22 ' A' ' 62' ' ' LEU . 98.4 mttt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.042 0.449 . . . . 0.0 110.096 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -58.07 -42.88 86.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.147 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.51 92.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.371 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -60.37 -42.73 96.42 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.62 -42.83 99.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.7 -45.52 97.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -61.58 -41.73 97.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.205 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -63.9 -38.94 92.95 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.294 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.488 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 2.9 tm? -59.54 -48.52 81.32 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.755 -0.778 . . . . 0.0 109.841 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -63.6 -38.67 92.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.639 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 78.2 t -62.81 -46.42 96.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.428 HD12 HG21 ' A' ' 84' ' ' ILE . 96.8 mt -60.32 -48.89 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.52 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.49 -40.8 93.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.4 . . . . 0.0 110.897 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.85 -47.74 83.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.68 -44.13 97.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.104 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -34.69 78.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.106 0.479 . . . . 0.0 109.954 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.46 25.9 55.76 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.9 mt . . . . . 0 C--O 1.231 0.107 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.513 179.773 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.237 0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.408 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.597 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 99.1 mt-10 -54.84 -24.65 24.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.259 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 57.0 mtpt -60.15 -49.72 76.53 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.096 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.87 -44.75 69.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.975 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.426 ' NE1' HD13 ' A' ' 135' ' ' LEU . 9.2 t-105 -59.07 -48.84 80.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.49 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.597 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.435 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.2 OUTLIER -55.91 -51.28 68.16 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.729 -178.812 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.29 -46.7 63.76 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.814 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -51.68 -51.53 55.18 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.648 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -76.68 -41.99 43.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.821 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.9 t -45.55 -27.34 0.73 Allowed 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.062 0.458 . . . . 0.0 109.912 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.12 -91.79 0.08 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.426 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' ' 131' ' ' SER . 11.8 ptmt -165.62 31.03 0.05 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -65.13 43.4 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.341 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.56 ' H ' ' C ' ' A' ' 129' ' ' LYS . 6.7 m -98.36 123.54 42.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.651 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 112.7 -97.29 0.88 Allowed Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.076 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -78.61 -43.24 26.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.749 0.309 . . . . 0.0 111.246 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -60.97 -51.97 66.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 0.0 110.142 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.426 HD13 ' NE1' ' A' ' 121' ' ' TRP . 2.2 mt -62.43 -42.89 99.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.035 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.21 -39.95 92.15 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 2.9 mmpt? -61.49 -42.1 98.28 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.281 0.562 . . . . 0.0 109.869 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mt -58.05 -43.39 86.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -36.15 82.74 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 176.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.507 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 6.5 mpt_? -54.12 -42.95 70.03 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . 0.522 ' OE1' ' O ' ' A' ' 137' ' ' LYS . 5.6 mp0 -70.09 -41.86 73.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.825 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -61.06 -53.73 53.52 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.693 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 98.9 mt -59.92 -40.71 89.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.097 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' A' ' 140' ' ' ARG . 6.4 m80 -56.48 -44.28 80.48 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -63.28 -38.68 92.11 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.592 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -60.82 -43.14 98.6 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.106 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.722 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 98.1 mt-10 -69.83 -45.71 67.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.002 0.429 . . . . 0.0 111.684 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -70.65 -44.53 66.9 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.481 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . 0.543 ' CG1' ' N ' ' A' ' 150' ' ' HIS . 4.4 p -63.44 -49.34 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.983 -178.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.722 ' CD2' ' O ' ' A' ' 147' ' ' GLU . 0.2 OUTLIER -70.51 -23.25 62.62 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.004 -179.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.682 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 24.6 mt-10 -67.18 -52.28 43.3 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.814 179.091 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -63.25 -41.53 99.07 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -63.92 -40.1 95.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.231 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.454 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 19.8 t -60.38 -47.65 91.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.042 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 97.2 mt . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.844 179.907 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 . . . . . 0 CA--C 1.521 -0.173 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.617 ' CD2' ' HZ3' ' A' ' 193' ' ' LYS . 5.3 mt -62.3 -46.68 87.69 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.556 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.442 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.8 mttt -68.6 -38.27 80.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.942 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -67.81 -48.21 66.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.764 -178.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.617 ' HZ3' ' CD2' ' A' ' 190' ' ' LEU . 14.3 pttt -73.2 -41.18 64.09 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.011 -179.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.509 ' HG ' ' N ' ' A' ' 195' ' ' ARG . 0.3 OUTLIER -70.52 -41.77 72.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.849 -179.4 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.509 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 12.8 ptm180 -65.72 -38.99 90.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.434 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.0 -42.29 98.16 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 193' ' ' LYS . 82.2 mt -64.42 -43.86 97.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.761 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -62.09 -41.7 98.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.504 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.29 -31.94 73.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.338 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.57 78.41 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 24.8 mt -63.22 -40.8 98.5 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.864 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.56 -39.96 93.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -41.76 99.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.497 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 31.9 mt -60.9 -40.66 93.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.449 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -62.2 -44.24 97.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.294 0.569 . . . . 0.0 109.668 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.595 ' O ' ' N ' ' A' ' 210' ' ' GLN . 24.2 mmt85 -63.73 -39.54 94.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.069 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 211' ' ' GLY . 48.5 t -62.99 -45.64 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.042 0.449 . . . . 0.0 109.897 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 15.6 m -63.39 -29.51 70.8 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.339 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.9 m170 -93.57 -46.03 7.47 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.69 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.595 ' N ' ' O ' ' A' ' 206' ' ' ARG . 2.9 pp0? -105.56 -25.57 12.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.657 0.265 . . . . 0.0 111.112 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 N--CA 1.459 0.202 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 . . . . . 0 C--O 1.233 0.193 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.97 151.24 86.31 Favored Pre-proline 0 C--O 1.235 0.325 0 C-N-CA 119.136 -1.025 . . . . 0.0 108.314 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.616 ' O ' ' N ' ' A' ' 223' ' ' VAL . 78.0 Cg_exo -38.26 -79.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.28 1.987 . . . . 0.0 112.418 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 221' ' ' PRO . 43.6 ttm180 36.09 -84.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.092 0.472 . . . . 0.0 111.402 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.616 ' N ' ' O ' ' A' ' 221' ' ' PRO . 2.1 t -59.75 -65.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.139 0.495 . . . . 0.0 110.691 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 1.1 mp -51.19 -28.03 6.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.754 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 56.6 t0 -63.51 -45.91 88.47 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 109.868 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.1 mt -61.2 -42.13 98.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.596 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . 0.42 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 44.2 m0 -61.49 -36.67 81.12 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.355 -0.538 . . . . 0.0 109.949 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.8 -40.21 94.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 231' ' ' GLN . 96.8 mt -64.02 -41.81 97.33 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.263 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -36.68 -29.39 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.999 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 229' ' ' LEU . 89.1 mt-30 -62.49 -65.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.715 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 5.4 t -87.05 14.69 7.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.688 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -80.47 -76.1 0.24 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.805 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -173.26 81.66 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.905 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 76.5 mt -141.54 149.26 40.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.615 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 70.4 p -71.3 -167.01 0.2 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.407 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . 0.472 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 27.0 p-10 -82.53 -47.82 11.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.327 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . 0.401 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 65.1 mttp -63.38 -44.33 95.03 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.081 0.467 . . . . 0.0 110.625 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -62.3 -36.45 82.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.686 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . 0.411 ' C ' ' CD1' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.2 -45.0 93.73 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.535 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -62.08 -46.73 87.81 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.465 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -63.24 -40.85 98.6 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.06 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.526 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -65.71 -43.73 88.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.52 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . 0.401 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 0.0 OUTLIER -59.99 -48.21 82.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.009 0.433 . . . . 0.0 110.441 -178.703 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -65.19 -46.08 82.2 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.825 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -57.27 -50.17 73.76 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.071 0.462 . . . . 0.0 110.345 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.417 HD22 ' O ' ' A' ' 243' ' ' PHE . 4.0 mm? -63.97 -37.39 87.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.687 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.65 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.4 tttt -55.28 -47.63 75.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.061 0.458 . . . . 0.0 109.866 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -67.48 -43.77 80.16 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.076 -0.649 . . . . 0.0 110.989 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 29.9 t80 -60.65 -48.06 83.46 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.509 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.65 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.9 OUTLIER -61.86 -36.63 81.81 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.04 -41.6 90.66 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.826 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.45 -46.9 86.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 111.137 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -38.81 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.791 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -55.83 -48.8 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.343 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -62.24 -43.11 99.57 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.26 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -57.83 -43.1 85.6 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.131 0.491 . . . . 0.0 110.291 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -61.52 -40.97 96.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.364 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -59.18 -46.69 87.74 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 120.954 0.407 . . . . 0.0 110.285 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -62.07 -37.5 85.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.28 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.515 HE21 ' CG2' ' A' ' 297' ' ' THR . 90.0 mm-40 -61.6 -42.62 99.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.524 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 24.1 mmtp -62.0 -45.64 92.74 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.098 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -66.34 -35.99 81.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.148 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.31 -43.73 98.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.39 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.46 -45.38 83.98 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.677 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 55.9 mt -62.97 -43.27 98.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.734 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.14 -38.63 83.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.035 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.29 -47.42 86.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.407 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -58.43 -48.85 79.37 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.361 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -61.11 -37.66 83.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 4.7 tt -59.81 -44.26 94.07 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -61.35 -44.81 96.55 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.078 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.49 -44.6 82.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.863 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.03 -34.69 73.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -59.92 -35.16 74.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.962 0.411 . . . . 0.0 110.116 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 15.6 m -61.25 -31.47 71.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.834 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.34 -44.04 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.453 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 105.03 6.1 40.12 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -84.35 100.47 11.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.379 . . . . 0.0 110.127 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.3 86.87 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -55.58 -50.8 69.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.582 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -66.53 -38.28 86.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.93 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 72.5 t -60.87 -47.29 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.48 -46.4 88.65 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.054 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -62.44 -43.03 99.81 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.706 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.2 t -60.47 -45.14 94.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.459 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -64.07 -36.65 84.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.708 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.61 -58.87 6.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . 0.444 ' HZ1' HD22 ' A' ' 292' ' ' LEU . 28.5 mmtt -64.34 -33.48 75.94 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.061 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 -55.26 -48.67 73.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.443 -0.503 . . . . 0.0 109.919 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.84 -39.1 80.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.964 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . 0.444 HD22 ' HZ1' ' A' ' 289' ' ' LYS . 8.5 tp -62.28 -54.92 33.71 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.736 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 9.8 tp -62.65 -42.43 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.181 0.515 . . . . 0.0 109.958 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.488 ' O ' ' OG1' ' A' ' 297' ' ' THR . 81.7 tt0 -63.35 -36.98 85.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.993 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.47 -45.71 94.21 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -60.56 -44.03 96.63 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.056 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.515 ' CG2' HE21 ' A' ' 261' ' ' GLN . 21.9 p -59.39 -39.84 84.66 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.563 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.77 -47.47 83.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.029 0.442 . . . . 0.0 110.838 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.2 -41.29 92.67 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.092 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.953 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.44 -40.0 91.47 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -61.54 -46.7 88.82 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 110.486 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 17.7 m -60.34 -45.21 94.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.542 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.98 -42.18 91.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.854 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -56.59 -48.75 76.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.752 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -61.56 -42.89 99.5 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.185 0.517 . . . . 0.0 110.457 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -68.95 -31.09 69.71 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.311 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.94 -49.01 77.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.327 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 310' ' ' ASP . 12.5 pt20 -67.88 -42.0 81.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . 0.444 ' OD1' ' NE ' ' A' ' 314' ' ' ARG . 48.4 t0 -62.29 -51.1 69.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.995 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.45 -40.19 95.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.883 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 66.5 m -58.58 -44.79 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.64 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -70.13 -45.47 55.98 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.462 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . 0.444 ' NE ' ' OD1' ' A' ' 310' ' ' ASP . 95.1 mtt-85 -63.44 -47.52 81.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.724 0.297 . . . . 0.0 111.23 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -65.59 -43.19 94.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.643 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.453 ' HG ' ' N ' ' A' ' 317' ' ' ARG . 78.0 p -58.51 -38.08 76.94 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.508 -0.477 . . . . 0.0 109.932 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.453 ' N ' ' HG ' ' A' ' 316' ' ' SER . 43.2 tpt85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.775 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 C--O 1.233 0.22 0 CA-C-O 120.826 0.346 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -65.47 -34.62 78.7 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.0 mmm -124.18 149.92 45.78 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.405 0.621 . . . . 0.0 110.648 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.557 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 52.5 mp0 -61.62 -41.71 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.424 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -46.08 -57.04 4.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.173 0.511 . . . . 0.0 110.494 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.5 mt -59.79 -35.38 74.55 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.867 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -64.55 -39.35 93.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.394 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.36 -46.87 88.41 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.14 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -59.77 -41.82 91.91 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.46 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 29.1 t-105 -59.92 -43.41 94.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 0.0 110.401 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -57.9 -41.98 83.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.206 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -61.25 -41.58 97.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.39 95.17 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.324 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.473 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 76.6 mt-30 -62.39 -38.4 89.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.32 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.527 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.0 mt -65.27 -38.37 90.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.446 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.35 109.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.3 mt -134.42 154.9 80.07 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -37.91 154.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.816 2.344 . . . . 0.0 112.202 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.95 -47.02 2.73 Favored 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.736 2.29 . . . . 0.0 112.551 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.6 m -61.31 -47.18 94.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.452 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.4 ttm-85 -64.9 -40.64 95.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.434 179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.14 -43.92 97.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.58 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.69 97.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.514 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -66.19 -47.09 75.06 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.618 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.01 -47.75 85.0 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.374 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -59.24 -41.25 88.3 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.293 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.46 93.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.391 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -58.4 -45.79 87.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.137 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.1 mt -58.51 -41.49 85.53 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.178 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -59.15 -39.84 83.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.062 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mm -63.09 -43.02 98.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.858 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -56.4 -47.49 78.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.263 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -61.32 -44.36 97.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.107 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -60.02 -45.49 92.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.577 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -63.1 -37.83 88.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.655 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.0 -49.52 77.11 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.274 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.3 tp -59.44 -41.15 88.93 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.19 0.519 . . . . 0.0 110.163 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.56 -50.97 71.37 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.568 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -57.82 -38.86 76.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.423 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -57.1 -45.77 83.13 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -60.59 -48.93 79.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.178 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.573 ' C ' ' CD1' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.03 -35.65 80.93 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.025 -0.67 . . . . 0.0 109.641 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.434 ' N ' ' HG ' ' A' ' 62' ' ' LEU . 29.3 tptp -61.26 -41.26 96.62 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 34.9 tp . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.734 179.194 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.816 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -66.2 -32.67 74.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.713 0.292 . . . . 0.0 110.343 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.63 -49.45 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.268 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -62.33 -44.0 97.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.359 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.31 90.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.452 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -62.6 -42.45 99.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.911 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.5 mt -62.85 -44.57 95.77 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.057 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.65 -47.36 91.57 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.266 0.555 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -61.35 -40.89 95.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.049 179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -60.7 -41.2 94.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.373 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.422 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -60.21 -47.43 85.98 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.253 0.549 . . . . 0.0 110.049 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 28.6 t-20 -67.42 -37.53 83.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.56 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 43.5 t -62.43 -48.27 89.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.441 -179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.412 HD11 HG23 ' A' ' 84' ' ' ILE . 96.9 mt -61.44 -48.33 89.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.536 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.99 -42.19 97.26 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.85 87.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.348 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.76 -47.29 85.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.497 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -76.12 -21.14 56.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.439 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.98 27.51 70.33 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.6 mt . . . . . 0 C--N 1.33 -0.253 0 CA-C-O 120.662 0.267 . . . . 0.0 110.592 179.86 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.464 ' N ' ' CD1' ' A' ' 117' ' ' LEU . 10.0 mp . . . . . 0 N--CA 1.457 -0.096 0 CA-C-O 120.825 0.345 . . . . 0.0 110.714 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.605 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 99.1 mt-10 -56.17 -31.34 63.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.071 0.462 . . . . 0.0 110.444 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.59 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 99.6 mttt -64.66 -48.12 75.95 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.533 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 50.7 mt -71.42 -45.83 61.71 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.983 0.42 . . . . 0.0 111.889 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.448 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 9.4 t-105 -58.67 -48.69 80.23 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.605 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.2 m-70 -69.87 -32.59 71.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.378 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 13.1 tptt -59.31 -48.55 81.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.733 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.98 -47.61 65.16 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.696 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -57.23 -49.51 75.79 Favored 'General case' 0 C--O 1.23 0.04 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.121 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 5.2 m -74.91 -46.43 36.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.74 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 41.7 p -45.85 -29.26 1.3 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.122 -178.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -155.72 -95.63 0.11 Allowed Glycine 0 N--CA 1.463 0.489 0 C-N-CA 119.928 -1.129 . . . . 0.0 111.173 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.568 ' C ' ' H ' ' A' ' 131' ' ' SER . 26.9 mttm -163.86 27.87 0.08 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.47 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.6 m-30 -63.5 44.58 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.651 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.568 ' H ' ' C ' ' A' ' 129' ' ' LYS . 9.5 p -100.95 112.4 24.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.436 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 124.98 -97.12 0.53 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.076 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -78.17 -42.88 30.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.854 0.359 . . . . 0.0 110.841 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.47 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 53.0 mp0 -60.63 -53.56 55.98 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.948 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.8 mt -61.84 -41.18 97.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.175 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -60.0 -44.53 94.49 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.085 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -59.61 -43.84 93.62 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.449 HD23 ' N ' ' A' ' 138' ' ' LEU . 3.0 mm? -59.31 -42.53 91.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.293 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.532 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -64.94 -37.82 88.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.42 -0.809 . . . . 0.0 113.027 176.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 94.5 mtt180 -52.37 -43.72 64.85 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.64 -40.1 76.72 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.776 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.532 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.2 m-85 -58.36 -55.22 37.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.33 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 59.9 mt -59.66 -38.48 81.57 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.22 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.428 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 54.0 m170 -54.1 -47.66 71.53 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.848 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.43 ' HD1' HG23 ' A' ' 197' ' ' ILE . 8.0 m-70 -61.71 -39.19 90.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -60.34 -41.98 94.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.26 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -65.01 -55.17 20.52 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.823 0.344 . . . . 0.0 111.297 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.43 -45.22 94.08 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.987 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . 0.46 ' CG1' ' ND2' ' A' ' 153' ' ' ASN . 51.5 t -64.1 -35.5 73.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.949 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.608 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.2 m170 -66.1 -41.75 90.2 Favored 'General case' 0 C--O 1.209 -1.042 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.014 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.9 -43.65 98.24 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.091 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.49 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 17.1 m-85 -70.5 -46.45 63.67 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.544 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . 0.46 ' ND2' ' CG1' ' A' ' 149' ' ' VAL . 89.5 m-20 -67.55 -42.59 82.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.59 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.608 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 76.2 t -61.54 -47.05 95.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.034 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.5 mt . . . . . 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.62 179.843 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.893 0.378 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.464 HD11 ' N ' ' A' ' 190' ' ' LEU . 8.1 mp -62.83 -42.64 99.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.691 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.505 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.1 mttm -67.97 -34.2 76.09 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.935 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.6 tt0 -67.69 -47.6 68.97 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.218 0.532 . . . . 0.0 111.362 -178.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.49 ' CE ' ' CD1' ' A' ' 152' ' ' TYR . 12.4 ptmt -73.28 -40.64 64.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.44 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.579 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.9 -40.29 75.72 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.818 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.657 ' NH1' HE22 ' A' ' 199' ' ' GLN . 3.4 ppt_? -65.6 -37.56 86.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.452 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 89.6 p -62.67 -43.88 97.68 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . 0.43 HG23 ' HD1' ' A' ' 145' ' ' HIS . 96.8 mt -65.86 -43.34 93.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.782 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -60.87 -40.93 94.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.361 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.657 HE22 ' NH1' ' A' ' 195' ' ' ARG . 31.8 mt-30 -63.08 -38.56 91.66 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.576 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.76 -43.89 98.6 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 18.9 mt -64.39 -39.04 93.09 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.01 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -59.76 -39.96 86.57 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.498 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 6.4 tmm_? -63.1 -42.68 99.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.393 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.86 -40.62 96.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.396 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -61.44 -41.68 97.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.749 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.707 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.1 mtp180 -62.3 -40.84 97.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.365 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.609 ' O ' ' N ' ' A' ' 211' ' ' GLY . 43.0 t -63.52 -46.09 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.083 0.468 . . . . 0.0 110.313 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -69.84 -26.65 64.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.508 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 41.1 m170 -101.81 -14.49 17.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.147 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.707 ' N ' ' O ' ' A' ' 206' ' ' ARG . 64.1 tp60 -132.27 -37.84 1.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.765 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.609 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.555 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 . . . . . 0 N--CA 1.464 0.259 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 221' ' ' PRO . 32.4 mm-40 -89.65 150.95 45.16 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.589 ' O ' ' HB3' ' A' ' 222' ' ' ARG . 51.1 Cg_exo -51.54 -155.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.771 2.314 . . . . 0.0 111.874 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.589 ' HB3' ' O ' ' A' ' 221' ' ' PRO . 41.5 ttm180 87.62 -102.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.71 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.419 ' CG1' ' N ' ' A' ' 224' ' ' ILE . 14.4 p -59.15 -44.95 92.89 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 110.636 -179.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.419 ' N ' ' CG1' ' A' ' 223' ' ' VAL . 4.1 mm -61.6 -41.14 89.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.075 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -60.98 -39.65 90.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.91 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 7.7 mt -59.71 -41.81 91.64 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.28 0.562 . . . . 0.0 109.769 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 54.8 m0 -61.42 -43.04 99.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.916 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.56 -25.52 65.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 232' ' ' SER . 2.8 mt -65.39 -43.33 91.02 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.93 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.438 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -34.8 -44.22 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.794 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -62.6 -47.91 81.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.652 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.547 ' O ' ' O ' ' A' ' 233' ' ' ALA . 35.7 t -67.6 -40.02 84.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.565 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . 0.547 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -47.93 -111.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.732 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -157.43 111.72 2.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 78.2 mt -146.36 161.64 39.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 236' ' ' THR . . . . . 0.549 ' OG1' ' HG2' ' A' ' 239' ' ' GLU . 0.0 OUTLIER -83.1 165.43 19.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.686 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -60.65 -47.38 86.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.991 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.1 -47.43 85.31 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 110.552 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . 0.549 ' HG2' ' OG1' ' A' ' 236' ' ' THR . 5.7 mm-40 -66.3 -35.77 81.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.002 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . 0.466 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.11 -43.31 98.79 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.206 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -63.01 -48.99 76.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.398 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.69 -44.18 97.43 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.344 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.474 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -62.41 -43.87 97.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.122 179.062 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -59.37 -46.69 87.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.047 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -66.19 -44.07 85.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.706 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -59.66 -49.59 77.14 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.597 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.6 mm? -62.65 -38.32 89.84 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.525 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.41 -41.14 84.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.829 0.347 . . . . 0.0 110.071 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -66.51 -61.01 2.21 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.555 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . 0.434 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 25.3 t80 -59.58 -45.76 90.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.511 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.6 tp10 -54.88 -38.51 67.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.163 0.506 . . . . 0.0 109.701 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.31 82.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.244 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -60.72 -47.94 84.03 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.857 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.469 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 2.6 tp -63.49 -37.39 79.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.126 179.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -59.66 -44.02 93.72 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 121.07 0.462 . . . . 0.0 109.888 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -63.27 -42.41 99.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.134 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . 0.411 ' NE2' HG23 ' A' ' 297' ' ' THR . 15.5 t-80 -56.93 -42.43 80.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.159 0.504 . . . . 0.0 110.127 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -63.24 -40.0 96.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.084 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . 0.456 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -58.35 -46.58 86.0 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.147 0.499 . . . . 0.0 110.338 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -62.98 -35.68 80.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.201 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.465 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 32.8 mm-40 -60.48 -45.02 95.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.117 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -62.05 -43.76 98.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.209 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . 0.456 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.8 mp0 -66.92 -37.86 85.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.203 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . 0.441 ' CD2' ' OE1' ' A' ' 294' ' ' GLU . 53.9 tp -62.39 -43.54 98.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.294 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -66.21 -45.39 80.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.429 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 51.8 mt -62.94 -43.22 98.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.243 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.68 -37.82 82.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.253 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.77 -45.49 86.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.446 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -62.81 -46.44 87.96 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.618 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 60.5 tptt -60.48 -42.08 95.52 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.658 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . 0.449 ' CD2' ' HE ' ' A' ' 287' ' ' ARG . 35.4 tp -61.78 -43.15 99.43 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.27 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -58.13 -42.81 86.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.176 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -73.56 -33.71 64.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.506 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . 0.406 ' O ' HG13 ' A' ' 277' ' ' VAL . . . -64.04 -40.78 97.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.656 -179.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -54.26 -18.9 4.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.892 0.377 . . . . 0.0 110.594 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 4.1 t -62.32 -32.86 73.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.636 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.487 HG13 ' H ' ' A' ' 278' ' ' GLY . 10.4 p -58.67 -45.16 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.421 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.487 ' H ' HG13 ' A' ' 277' ' ' VAL . . . 79.0 -10.26 34.42 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . 0.487 ' H ' HG12 ' A' ' 277' ' ' VAL . 54.1 m-20 -61.78 -38.6 88.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.661 0.267 . . . . 0.0 110.549 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . 0.661 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 98.11 -146.49 18.22 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . 0.458 ' OE1' ' C ' ' A' ' 280' ' ' GLY . 51.5 mp0 57.97 -65.03 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 110.778 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . 0.661 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -63.33 -37.97 89.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.665 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.81 -46.74 95.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.518 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 284' ' ' SER . . . . . 0.451 ' O ' ' OE1' ' A' ' 288' ' ' GLU . 12.0 t -63.1 -47.44 82.84 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.052 0.454 . . . . 0.0 110.933 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 73.3 ttp85 -64.11 -42.99 96.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.82 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 42.1 t -60.28 -43.79 95.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.453 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . 0.636 ' NH2' ' CG ' ' A' ' 290' ' ' HIS . 5.5 mmp_? -64.12 -37.74 88.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.06 0.457 . . . . 0.0 110.677 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . 0.451 ' OE1' ' O ' ' A' ' 284' ' ' SER . 0.4 OUTLIER -60.22 -56.38 22.21 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.324 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . 0.407 ' HZ1' HD23 ' A' ' 292' ' ' LEU . 28.3 mmtt -65.57 -34.94 79.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.979 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . 0.636 ' CG ' ' NH2' ' A' ' 287' ' ' ARG . 42.8 t-80 -51.84 -48.68 63.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.66 -37.01 79.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.541 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . 0.407 HD23 ' HZ1' ' A' ' 289' ' ' LYS . 14.6 tp -62.2 -49.93 73.79 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.555 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . 0.463 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.4 mp -62.91 -41.33 99.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.134 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.441 ' OE1' ' CD2' ' A' ' 264' ' ' LEU . 29.5 tp10 -62.99 -41.25 99.52 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -59.51 -48.22 87.08 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.15 -40.23 89.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 0.0 110.231 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.465 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 0.2 OUTLIER -56.84 -47.48 80.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.105 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -63.12 -42.41 99.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.452 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.73 -47.55 76.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.479 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.24 -43.44 96.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.512 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.82 -42.02 84.8 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . 0.602 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 53.5 t80 -62.66 -46.62 87.34 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.422 0.629 . . . . 0.0 110.587 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 303' ' ' THR . . . . . 0.417 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 15.7 m -61.69 -45.93 91.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.454 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.51 -30.74 50.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.203 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -62.6 -55.04 30.87 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 121.141 0.496 . . . . 0.0 110.516 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . 0.602 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 77.5 mttt -62.17 -42.67 99.49 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.81 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.417 ' ND1' ' O ' ' A' ' 303' ' ' THR . 60.2 m80 -63.9 -32.01 73.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.988 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.75 -48.44 79.19 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -66.84 -41.1 87.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.697 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -62.08 -49.12 77.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.793 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 26.6 mt -63.51 -40.58 97.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.029 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 312' ' ' SER . . . . . 0.47 ' O ' ' OG ' ' A' ' 316' ' ' SER . 6.7 t -60.02 -44.31 94.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.29 -44.86 84.31 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . 0.685 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -65.84 -43.61 87.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.877 0.37 . . . . 0.0 111.114 -179.599 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.3 mm -69.76 -24.02 26.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.47 ' OG ' ' O ' ' A' ' 312' ' ' SER . 67.7 m -59.14 -43.13 92.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.204 0.526 . . . . 0.0 110.057 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.251 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.755 0.312 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -61.19 -40.34 93.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 88.8 mmm -121.25 149.08 43.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.418 0.627 . . . . 0.0 111.074 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 23' ' ' GLU . 4.2 pm0 -61.58 -40.33 94.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.435 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -52.31 -48.79 65.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.179 0.514 . . . . 0.0 110.668 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.81 -39.47 91.87 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.359 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.9 t-20 -62.91 -38.82 92.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.189 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -61.74 -43.52 98.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.354 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.29 -42.68 99.06 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -61.16 -47.14 87.56 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.234 0.54 . . . . 0.0 110.44 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -57.51 -41.99 81.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -61.23 -43.1 99.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.238 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.87 88.11 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.071 0.462 . . . . 0.0 110.082 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.646 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 24.5 mt-30 -59.41 -39.31 83.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.173 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.603 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 61.6 ttt85 -60.96 -39.88 91.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.373 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.67 -34.53 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.296 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.646 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 24.9 m80 66.41 118.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.5 mt -137.13 154.61 75.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.115 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -41.74 154.62 0.09 OUTLIER 'Trans proline' 0 C--N 1.312 -1.354 0 C-N-CA 122.504 2.136 . . . . 0.0 112.41 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -56.5 -47.49 23.69 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.511 2.141 . . . . 0.0 112.375 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.8 -45.71 94.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.447 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpt180 -62.52 -41.89 99.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.58 -43.61 98.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.715 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.26 89.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.595 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -68.67 -42.38 77.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.528 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 50.9 tp -63.04 -48.67 77.74 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.23 0.538 . . . . 0.0 110.661 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -59.96 -42.77 94.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.25 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.6 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.33 -46.56 88.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.607 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -55.8 -47.78 76.53 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.485 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.0 -40.74 85.82 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.139 0.495 . . . . 0.0 109.988 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.49 -39.14 82.77 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.947 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 47' ' ' ALA . 35.9 mm -62.83 -42.71 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.59 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -55.79 -46.79 77.89 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.444 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -60.06 -50.48 73.56 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.355 0.597 . . . . 0.0 110.419 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.313 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -61.21 -40.57 94.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.385 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.18 -51.02 67.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.05 -39.65 93.09 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.242 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.5 92.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.63 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.429 ' CZ3' ' HD3' ' A' ' 63' ' ' LYS . 89.3 t90 -61.87 -40.26 94.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.267 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.743 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 87.8 tttt -57.61 -49.33 76.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.463 0.649 . . . . 0.0 109.556 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -66.46 -41.27 89.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.182 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.46 -44.16 97.59 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.618 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.743 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 18.4 pttm -61.93 -39.19 91.19 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 63' ' ' LYS . 56.5 tp . . . . . 0 CA--C 1.522 -0.117 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.509 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.619 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -60.61 -35.03 75.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.796 0.331 . . . . 0.0 110.361 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -62.07 -48.32 80.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.23 0.538 . . . . 0.0 110.003 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.37 -39.32 90.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.252 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.41 94.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.208 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -63.66 -39.74 95.1 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.466 -0.493 . . . . 0.0 109.754 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.7 mt -62.62 -45.23 93.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.431 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.24 -44.58 95.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.056 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -58.1 -42.63 86.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.885 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.429 ' O ' HG13 ' A' ' 84' ' ' ILE . 11.5 m120 -62.72 -39.62 94.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.308 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.403 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -57.78 -49.63 75.96 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.96 -179.359 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.446 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 53.9 t-20 -64.68 -37.37 87.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.336 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 72.7 t -63.16 -45.8 97.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.466 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.444 HG21 HD13 ' A' ' 84' ' ' ILE . 97.0 mt -59.17 -50.34 80.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.061 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.438 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.6 mm? -65.44 -39.77 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.769 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.84 -45.23 95.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.65 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -62.83 -45.87 90.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.849 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -64.44 -28.04 69.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.297 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.18 23.29 61.45 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.7 mt . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.8 0.333 . . . . 0.0 110.398 179.851 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.1 mt . . . . . 0 C--O 1.238 0.465 0 CA-C-O 121.234 0.54 . . . . 0.0 110.664 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.56 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 96.8 mt-10 -58.81 -33.18 70.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.333 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 56.6 mttp -60.8 -47.97 83.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.712 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.19 -45.82 86.65 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.206 0.527 . . . . 0.0 111.928 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.416 ' CE2' HD11 ' A' ' 135' ' ' LEU . 14.3 t-105 -60.86 -51.5 69.05 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.975 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.56 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.7 m-70 -68.88 -29.32 67.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.234 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.634 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.1 tptt -57.6 -49.97 74.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.452 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.68 -47.56 53.33 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 119.3 -0.96 . . . . 0.0 111.022 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -53.21 -48.47 68.1 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.875 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 10.5 m -78.91 -43.28 25.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.897 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.589 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 18.0 m -44.73 -28.49 0.63 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -163.87 -96.03 0.11 Allowed Glycine 0 C--N 1.321 -0.259 0 C-N-CA 119.684 -1.246 . . . . 0.0 111.576 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.638 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -152.02 20.5 0.68 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.453 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 2.6 m-85 -59.53 41.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.613 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.638 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.5 p -103.0 114.46 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.976 0.417 . . . . 0.0 111.247 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.442 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 120.92 -96.88 0.61 Allowed Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.788 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.457 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 79.7 mm-40 -72.97 -43.77 61.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.909 0.385 . . . . 0.0 111.342 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 4.1 mp0 -65.52 -45.8 82.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.126 0.489 . . . . 0.0 110.165 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.442 ' HB2' ' H ' ' A' ' 132' ' ' GLY . 1.7 mt -60.64 -41.9 95.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.898 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.502 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -63.01 -40.23 97.15 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.92 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -59.56 -44.36 93.3 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 121.273 0.558 . . . . 0.0 110.207 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.431 ' N ' HD22 ' A' ' 138' ' ' LEU . 3.1 mm? -60.84 -42.52 97.94 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -30.67 70.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 176.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' A' ' 136' ' ' ASP . 59.6 mmt-85 -59.02 -44.16 91.69 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.432 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -71.02 -39.44 72.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.859 179.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.27 -58.28 9.2 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.565 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 93.9 mt -61.0 -39.29 89.12 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.218 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -55.25 -43.02 74.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.441 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -64.84 -38.23 90.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.407 ' O ' HG12 ' A' ' 149' ' ' VAL . 51.5 mmtt -59.64 -45.03 93.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.403 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -70.48 -51.74 26.91 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.739 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.442 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 14.5 mptt -62.54 -44.51 96.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.157 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 146' ' ' LYS . 2.6 p -63.77 -35.95 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.501 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.602 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 1.9 m170 -66.01 -43.23 88.32 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.665 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.99 -44.7 96.18 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.364 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.442 ' CD2' ' O ' ' A' ' 148' ' ' LYS . 31.4 m-85 -69.58 -46.76 65.61 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.904 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -65.59 -41.07 93.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.103 0.478 . . . . 0.0 110.527 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.602 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 63.8 t -63.08 -43.92 99.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.674 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 44.7 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.561 179.64 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 193' ' ' LYS . 75.7 mm-40 . . . . . 0 CA--C 1.518 -0.268 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.539 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 21.1 mt -61.16 -41.62 97.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.932 0.396 . . . . 0.0 110.208 178.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -67.68 -35.92 79.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.815 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 79.8 mm-40 -67.06 -45.65 76.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.981 0.42 . . . . 0.0 111.492 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.539 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 4.5 ptmt -69.25 -36.54 77.25 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.936 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.585 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -62.53 -44.11 97.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.989 -179.521 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.525 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 16.0 ptm180 -65.78 -35.87 81.93 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.417 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.423 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 72.4 m -59.5 -40.56 87.43 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.76 -42.98 97.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.399 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -58.84 -41.99 88.24 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.61 -38.54 88.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.33 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.55 -41.68 97.36 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.213 -1.155 . . . . 0.0 110.213 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 20.4 mt -61.94 -40.14 94.5 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.672 178.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -62.04 -36.53 81.87 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.445 ' HD3' ' O ' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -62.45 -42.49 99.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.248 178.832 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.4 mt -60.19 -39.36 86.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.451 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -60.44 -41.8 94.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.604 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.642 ' O ' ' N ' ' A' ' 210' ' ' GLN . 25.9 mmt85 -62.43 -38.62 90.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.117 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.591 ' O ' ' N ' ' A' ' 211' ' ' GLY . 30.4 t -63.64 -45.09 98.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.302 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -66.13 -28.17 68.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.471 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -94.64 -39.45 10.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.026 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.642 ' N ' ' O ' ' A' ' 206' ' ' ARG . 56.2 tt0 -96.16 -40.46 9.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.399 . . . . 0.0 110.715 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.434 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.43 ' O ' ' O ' ' A' ' 220' ' ' GLU . 96.9 mt-10 . . . . . 0 N--CA 1.454 -0.247 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.655 ' C ' ' H ' ' A' ' 222' ' ' ARG . 7.3 mt-10 41.12 103.69 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.264 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.486 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 32.1 Cg_exo -57.97 15.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 123.023 2.482 . . . . 0.0 112.243 177.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.655 ' H ' ' C ' ' A' ' 220' ' ' GLU . 84.8 mtt85 -112.66 -59.81 1.96 Allowed 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.853 0.359 . . . . 0.0 110.692 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.635 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 6.2 p -65.37 -64.61 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-O 121.404 0.621 . . . . 0.0 111.326 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.635 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 0.4 OUTLIER -62.3 -32.39 54.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.721 -179.151 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 21.8 t70 -63.0 -40.74 98.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.303 0.573 . . . . 0.0 109.836 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.8 mt -61.42 -40.78 95.66 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . 0.411 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 40.0 m0 -59.75 -38.28 81.33 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.059 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -63.22 -37.55 87.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.419 ' C ' ' H ' ' A' ' 231' ' ' GLN . 93.3 mt -63.96 -41.86 97.45 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.366 0.603 . . . . 0.0 110.199 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -50.03 -14.88 0.17 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.835 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.5 ' CG ' ' N ' ' A' ' 232' ' ' SER . 18.3 pt20 -64.82 -42.83 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.759 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.5 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 23.7 m -136.95 58.03 1.74 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -109.28 45.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.403 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 65.84 53.38 1.15 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.998 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . 0.444 ' N ' ' CD2' ' A' ' 235' ' ' LEU . 4.2 mm? -108.56 177.87 4.66 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.066 0.46 . . . . 0.0 110.447 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 236' ' ' THR . . . . . 0.477 ' OG1' ' CG ' ' A' ' 239' ' ' GLU . 60.6 p -84.57 -176.23 6.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.477 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -85.47 -50.78 7.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.202 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -62.01 -44.72 96.12 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.033 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . 0.477 ' CG ' ' OG1' ' A' ' 236' ' ' THR . 85.8 mt-10 -61.87 -34.28 75.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.77 -42.08 95.39 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.837 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -64.3 -49.09 73.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.512 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.42 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.126 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.3 -43.25 95.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.456 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -56.43 -51.28 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 110.381 -178.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -66.54 -39.95 88.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.744 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -58.89 -53.99 52.13 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.207 0.527 . . . . 0.0 110.447 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.08 -33.81 76.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.444 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.692 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.9 tttt -57.28 -44.96 84.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.224 0.535 . . . . 0.0 110.072 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -68.96 -44.04 73.77 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.604 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -61.24 -47.2 87.15 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 120.991 0.424 . . . . 0.0 111.088 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.692 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.0 OUTLIER -61.28 -36.27 79.58 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.72 87.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.69 -48.16 80.5 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.233 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 1.2 tt -65.02 -34.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.096 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -64.57 -44.73 89.8 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.34 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.82 -44.31 96.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.332 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -44.8 73.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -60.71 -40.76 93.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.29 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -59.78 -47.22 86.57 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.515 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -63.94 -34.52 78.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.397 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.561 HE21 ' CG2' ' A' ' 297' ' ' THR . 72.5 mm-40 -61.8 -46.87 87.66 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.189 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.99 -46.76 87.83 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.05 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -64.38 -34.96 79.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.987 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 60.5 tp -62.62 -42.9 99.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -64.81 -44.66 89.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.712 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.42 -43.26 98.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.192 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.4 -38.6 87.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.099 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -61.54 -46.79 88.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.87 -49.12 78.93 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -61.89 -38.75 89.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.516 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.04 -43.06 99.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.261 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -60.27 -43.27 96.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.403 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -65.9 -39.88 91.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.29 -38.32 89.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.941 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -63.9 -30.37 71.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.517 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 6.4 t -59.39 -40.16 85.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.536 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 91.5 t -60.75 -45.31 97.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.495 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 86.35 18.72 58.45 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.03 -38.24 90.36 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.292 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 81.47 -164.76 45.73 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 63.27 -70.58 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.8 0.333 . . . . 0.0 110.619 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 280' ' ' GLY . 11.2 ptp85 -67.97 -24.56 65.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.825 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.9 -47.59 92.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.421 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 38.6 t -66.55 -44.86 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.18 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.03 -49.49 77.19 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.876 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 71.7 m -60.83 -43.96 97.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -63.63 -39.06 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.724 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -58.36 -57.18 14.02 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.95 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -64.28 -36.49 84.27 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.077 179.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -49.23 -50.05 40.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.78 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.4 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.601 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 22.8 tp -59.98 -49.72 76.58 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.548 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.17 -42.07 99.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.014 0.435 . . . . 0.0 109.891 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.59 ' O ' ' OG1' ' A' ' 297' ' ' THR . 12.3 tm-20 -60.97 -40.12 92.2 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.04 -43.22 99.46 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.26 -43.95 98.04 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.227 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.59 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 25.3 p -57.36 -43.86 83.87 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.99 0.424 . . . . 0.0 110.121 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -62.79 -46.36 88.36 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.137 0.494 . . . . 0.0 110.681 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.52 -39.92 89.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.144 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.85 -43.86 98.0 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.152 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.72 -42.55 96.42 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -61.52 -44.89 96.25 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.137 0.494 . . . . 0.0 110.616 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.3 m -60.52 -43.93 96.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.352 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.8 t -59.81 -42.76 90.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.921 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.71 -50.51 72.97 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.031 0.443 . . . . 0.0 110.596 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -63.77 -41.18 98.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.682 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -66.23 -34.98 79.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.011 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 19.3 mt -62.14 -43.72 98.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.378 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -68.53 -43.87 75.83 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.737 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -64.15 -49.53 71.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.112 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 28.1 mt -63.89 -41.32 97.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 74.7 m -59.64 -41.81 91.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.545 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -68.4 -47.47 57.49 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -66.1 -42.35 89.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.785 0.326 . . . . 0.0 111.269 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -70.23 -23.75 25.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.94 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.4 t -59.66 -43.84 93.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 109.735 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.732 179.392 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 . . . . . 0 N--CA 1.462 0.131 0 CA-C-O 120.758 0.313 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.489 ' C ' ' SD ' ' A' ' 22' ' ' MET . 85.5 mtp180 -92.38 -4.08 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.78 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.601 ' CG ' ' HZ3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -133.56 137.98 45.8 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.027 0.441 . . . . 0.0 111.109 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 16.6 pt-20 -65.12 -42.59 93.77 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.601 ' HZ3' ' CG ' ' A' ' 22' ' ' MET . 13.2 pttm -57.0 -45.42 83.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.0 0.429 . . . . 0.0 109.963 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.1 mp -61.62 -41.51 97.58 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.1 m-80 -62.09 -38.75 90.03 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.199 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -59.01 -48.78 80.36 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.885 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.432 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 4.1 mm? -61.97 -42.14 98.79 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.116 179.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.645 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 61.1 t-105 -61.12 -45.06 96.23 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.072 0.463 . . . . 0.0 110.383 179.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.439 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 81.3 tt0 -56.85 -46.04 82.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.372 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -61.71 -40.56 95.48 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.474 -0.491 . . . . 0.0 110.281 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.91 -43.9 86.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.645 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 88.2 mt-30 -62.81 -38.5 90.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.232 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.439 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -61.19 -41.66 97.21 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.376 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.17 -41.17 97.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.337 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.33 104.83 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.47 158.51 64.2 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.354 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -39.12 153.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.478 0 C-N-CA 122.593 2.195 . . . . 0.0 112.417 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.5 -41.77 68.25 Favored 'Trans proline' 0 N--CA 1.499 1.837 0 C-N-CA 122.812 2.341 . . . . 0.0 112.538 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 70.6 t -62.69 -46.42 96.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -64.76 -38.52 91.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.335 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.25 -46.08 88.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.18 -42.67 83.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.866 0.365 . . . . 0.0 110.816 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -67.63 -45.27 75.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.564 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.13 -48.89 76.57 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.523 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -60.3 -41.31 93.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.282 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.571 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.97 -50.41 74.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -57.65 -48.11 80.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.946 0.403 . . . . 0.0 110.996 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.71 -39.82 81.91 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.01 -40.46 89.34 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.882 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.571 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.6 mm -62.45 -43.84 98.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -58.42 -42.89 88.28 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.684 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.49 -49.56 77.05 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.155 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -63.0 -41.57 99.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.792 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 55' ' ' ASP . 48.5 t0 -63.34 -39.38 94.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.356 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.33 -46.38 90.51 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.848 0.356 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.6 tp -61.4 -43.52 98.73 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.722 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.98 -44.5 96.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.696 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.3 t90 -56.33 -42.45 77.7 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.2 tttt -60.52 -45.92 92.03 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.688 -0.405 . . . . 0.0 109.977 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -60.47 -42.64 96.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.265 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mp -62.03 -40.64 96.4 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.341 -0.544 . . . . 0.0 109.653 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.96 -40.72 85.6 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.5 tt . . . . . 0 C--N 1.328 -0.332 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -179.945 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.76 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -66.81 -34.39 77.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.453 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.449 ' HD2' ' N ' ' A' ' 73' ' ' LYS . 2.7 mptp? -61.44 -68.09 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.074 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -51.74 -39.14 57.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.367 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.53 95.11 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.412 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.462 ' NH1' HD22 ' A' ' 80' ' ' ASN . 73.7 ttt-85 -62.62 -43.07 99.73 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.01 -43.37 98.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.573 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.58 -44.69 98.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.148 0.499 . . . . 0.0 109.95 179.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -59.86 -41.74 92.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.236 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.462 HD22 ' NH1' ' A' ' 76' ' ' ARG . 92.1 m-20 -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.532 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -49.19 78.79 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.753 -179.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.422 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 50.8 t-20 -64.21 -40.44 96.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.678 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.0 -45.81 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.773 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.444 HG23 HD13 ' A' ' 84' ' ' ILE . 96.5 mt -60.65 -48.85 86.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.318 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.5 -38.56 90.08 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.76 77.27 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.319 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.73 -46.1 83.67 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.288 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -63.85 -27.7 69.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.946 0.403 . . . . 0.0 110.121 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.38 29.37 73.08 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.3 mt . . . . . 0 C--N 1.332 -0.157 0 CA-C-O 120.878 0.37 . . . . 0.0 110.798 -179.728 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 58.2 mt . . . . . 0 C--O 1.234 0.251 0 CA-C-O 120.882 0.372 . . . . 0.0 110.644 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 77.9 mt-10 -60.48 -25.2 65.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.937 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.49 -55.76 29.53 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.52 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 32.1 mt -68.96 -42.33 76.76 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 112.112 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.472 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 7.5 t-105 -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.739 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.593 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.4 m-70 -68.0 -32.92 73.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.054 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.464 ' O ' ' CB ' ' A' ' 127' ' ' SER . 13.1 tptt -57.52 -49.56 75.93 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.96 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -69.15 -47.41 65.09 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.654 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.428 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 37.3 ttmt -54.6 -50.72 67.38 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.649 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 54.7 m -74.31 -41.9 60.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.932 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.3 t -48.62 -26.15 2.11 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 -178.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.67 -94.22 0.1 OUTLIER Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.041 -1.076 . . . . 0.0 111.515 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.517 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.4 pttm -162.83 30.97 0.1 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.504 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 6.5 m-85 -64.31 49.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.233 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.6 p -104.5 137.4 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.197 0.522 . . . . 0.0 111.767 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 95.45 -97.34 2.1 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-N 115.234 -0.893 . . . . 0.0 112.218 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -78.14 -43.91 27.49 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.8 0.333 . . . . 0.0 111.679 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.61 -52.52 64.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.054 0.454 . . . . 0.0 110.197 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 130' ' ' PHE . 1.6 mt -62.05 -41.44 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.938 179.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -61.3 -37.97 85.15 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 56.1 mmtt -62.03 -42.41 99.15 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.1 mp -59.73 -42.56 93.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -36.94 85.96 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.569 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 72.5 mtp85 -54.1 -42.13 69.06 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 118.588 -1.245 . . . . 0.0 108.149 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -69.23 -41.62 76.76 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.678 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -57.23 -57.57 12.02 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.583 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.56 -39.14 83.05 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.179 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.569 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 44.9 m170 -54.61 -43.16 71.96 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.416 -0.514 . . . . 0.0 109.846 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.62 -39.13 88.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.574 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -59.75 -46.3 89.57 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.192 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 10.2 pt-20 -69.89 -44.82 68.97 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.406 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 86.1 mttt -62.92 -46.7 86.58 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.233 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 55.1 t -64.49 -44.27 96.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.397 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.578 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.4 m170 -60.87 -38.54 85.98 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.465 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -61.49 -44.75 96.53 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.992 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.564 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 31.3 m-85 -66.74 -49.67 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.381 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -65.66 -41.03 93.01 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.953 0.406 . . . . 0.0 111.164 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.578 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 66.9 t -63.57 -44.54 98.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.727 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.2 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.511 179.373 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 . . . . . 0 C--O 1.23 0.07 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 3.4 mt -62.17 -39.79 93.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.156 179.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -66.64 -42.47 86.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.007 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -68.69 -35.79 77.66 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.567 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.564 ' HE3' ' CD1' ' A' ' 152' ' ' TYR . 26.9 mtpt -63.34 -46.95 84.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.487 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -72.24 -35.77 68.91 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.286 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.432 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 11.0 mmt85 -64.29 -41.36 96.91 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.626 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 69.8 m -65.47 -45.22 84.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.229 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 90.7 mt -66.33 -44.31 91.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.176 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -65.73 -40.83 92.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.029 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 195' ' ' ARG . 79.3 mt-30 -64.32 -36.68 84.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.23 178.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.98 -51.83 50.04 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 31.0 mt -64.29 -41.63 96.78 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.222 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -63.58 -36.6 84.34 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.668 ' HE ' HG22 ' A' ' 207' ' ' VAL . 0.0 OUTLIER -63.16 -44.16 96.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.72 179.101 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 33.3 mt -62.02 -39.03 90.91 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -61.93 -45.6 92.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.968 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.69 ' O ' ' N ' ' A' ' 210' ' ' GLN . 90.3 mmt-85 -65.76 -42.35 90.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.092 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.684 ' O ' ' N ' ' A' ' 211' ' ' GLY . 77.0 t -64.09 -45.36 96.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.061 0.457 . . . . 0.0 110.319 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -67.47 -28.85 68.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.659 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -101.21 -14.11 17.84 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.712 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.69 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.1 tt0 -140.15 -20.32 0.87 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.619 0.247 . . . . 0.0 111.361 -179.031 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.684 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 N--CA 1.461 0.339 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 220' ' ' GLU . 82.0 tt0 . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 219' ' ' GLU . 2.8 mt-10 55.36 153.59 0.06 OUTLIER Pre-proline 0 N--CA 1.472 0.64 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.675 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -83.12 81.79 2.28 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 122.201 1.934 . . . . 0.0 112.07 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -147.28 -98.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.968 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 7.5 p -60.52 -46.04 96.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.659 0 CA-C-O 121.154 0.502 . . . . 0.0 110.801 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.431 HD12 ' CZ ' ' A' ' 250' ' ' PHE . 0.7 OUTLIER -63.41 -35.64 73.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.818 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -62.09 -41.87 98.63 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.067 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 9.6 mt -59.39 -40.58 87.01 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 46.6 m0 -60.48 -43.98 96.39 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.04 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 3.6 mt -68.9 -43.82 74.45 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.331 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -39.64 -37.68 0.53 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.396 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -70.17 -45.87 65.84 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.173 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 91.6 p -80.11 -6.88 58.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.394 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -67.26 -121.28 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.376 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.38 69.58 0.22 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 110.544 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . 0.523 ' N ' ' CD2' ' A' ' 235' ' ' LEU . 3.4 mm? -100.76 -171.91 2.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.711 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 10.9 p -82.97 163.15 21.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.699 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -63.79 -46.89 83.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.892 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.51 -43.13 95.06 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.556 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -63.74 -36.29 83.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.084 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.79 -45.31 94.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.384 -179.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -64.24 -47.49 79.46 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.89 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.56 -41.98 99.25 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.816 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.498 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.23 -43.95 93.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.437 178.904 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -47.5 85.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.211 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.91 -46.97 79.45 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.354 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -56.44 -53.13 61.0 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.292 0.568 . . . . 0.0 110.382 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.443 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.03 -40.3 97.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.573 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 64.1 tttp -50.47 -45.46 56.21 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.76 -41.83 91.6 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.221 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . 0.551 ' CG ' ' N ' ' A' ' 251' ' ' GLU . 0.0 OUTLIER -58.64 -51.45 69.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.447 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.551 ' N ' ' CG ' ' A' ' 250' ' ' PHE . 11.6 pt-20 -59.59 -37.5 78.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.04 95.77 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.525 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.3 -46.22 87.73 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.41 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -64.64 -38.7 83.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -60.34 -44.91 95.09 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.515 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -61.63 -43.91 97.98 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . 0.532 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -55.95 -43.97 77.99 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.539 -0.464 . . . . 0.0 109.78 179.226 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . 0.532 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 39.9 t-20 -59.92 -41.16 91.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.237 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -59.0 -47.95 83.37 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.905 0.384 . . . . 0.0 110.296 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -61.8 -37.59 84.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.303 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.408 ' NE2' ' HB ' ' A' ' 297' ' ' THR . 62.1 mm-40 -59.16 -43.84 92.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.307 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -61.61 -47.76 83.98 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.13 0.49 . . . . 0.0 110.041 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -64.27 -35.06 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.03 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 65.3 tp -62.04 -42.99 99.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.201 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.21 -46.2 88.11 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.456 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.13 -43.63 98.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.164 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.55 78.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.251 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . 0.53 ' NE2' ' NE ' ' A' ' 272' ' ' ARG . 24.7 t60 -64.05 -46.1 85.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.318 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.95 -46.15 91.86 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 110.389 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.47 -39.41 90.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.356 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 2.6 tt -60.42 -44.59 95.61 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . 0.53 ' NE ' ' NE2' ' A' ' 268' ' ' HIS . 99.8 mtt180 -60.33 -44.17 95.75 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.21 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -67.77 -39.62 84.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.656 -0.417 . . . . 0.0 110.83 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . 0.426 ' CB ' HH11 ' A' ' 282' ' ' ARG . . . -60.59 -36.81 79.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.007 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.61 -24.5 63.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 0.0 110.364 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 9.0 t -88.32 3.46 49.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.868 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.466 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 11.3 p -61.11 -44.94 99.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.466 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 149.41 -98.44 0.19 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.72 -37.95 89.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.833 0.349 . . . . 0.0 110.164 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.14 46.75 8.93 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -68.72 -32.77 72.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.741 0.305 . . . . 0.0 110.755 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . 0.426 HH11 ' CB ' ' A' ' 274' ' ' ALA . 9.4 ptm180 -91.07 0.96 57.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.995 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 39.2 t -61.49 -46.33 96.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.7 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.5 t -61.74 -44.78 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.139 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 53.1 ttt85 -62.68 -46.8 86.48 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.952 0.406 . . . . 0.0 110.924 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.1 t -63.22 -45.07 93.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -63.9 -39.79 94.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -58.76 -59.58 5.2 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.019 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -64.02 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.866 -0.734 . . . . 0.0 110.044 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -46.19 -54.65 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.897 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.34 82.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.714 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 18.5 tp -59.77 -49.92 75.85 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.809 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.65 -42.0 98.16 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.38 0.61 . . . . 0.0 109.827 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.497 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.9 tt0 -62.91 -36.62 83.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.802 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.96 -42.86 98.13 Favored Glycine 0 CA--C 1.522 0.492 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.2 tpp85 -60.33 -44.47 95.47 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.08 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 35.2 p -58.87 -46.76 87.01 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.436 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -62.5 -45.07 94.7 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.05 0.453 . . . . 0.0 110.338 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -59.5 -39.99 85.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.71 -43.01 99.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.17 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.22 -42.15 97.09 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 61.5 t80 -61.93 -45.53 93.28 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.389 0.614 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 303' ' ' THR . . . . . 0.437 HG23 ' HD1' ' A' ' 307' ' ' HIS . 9.8 m -59.75 -42.58 93.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.763 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.74 -42.91 90.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -54.9 -52.17 63.75 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.571 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 50.1 mttt -62.46 -40.5 96.82 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.93 -0.708 . . . . 0.0 110.996 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.437 ' HD1' HG23 ' A' ' 303' ' ' THR . 7.8 m80 -64.46 -36.32 83.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.188 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.51 -43.74 98.08 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.448 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -66.94 -44.72 79.91 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.672 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -64.41 -48.55 74.97 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.405 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 31.8 mt -63.29 -41.73 99.01 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.523 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 11.5 t -61.0 -43.33 99.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.446 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.21 -51.8 52.23 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 120.931 -0.652 . . . . 0.0 111.682 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -67.2 -41.85 85.12 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.218 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 5.0 mm -63.76 -41.73 93.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.1 p -58.88 -41.22 86.61 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.502 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.4 tpp180 . . . . . 0 N--CA 1.449 -0.523 0 C-N-CA 117.814 -1.555 . . . . 0.0 108.146 176.81 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 . . . . . 0 N--CA 1.462 0.156 0 CA-C-O 120.685 0.279 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.679 ' NH2' ' OE2' ' A' ' 53' ' ' GLU . 89.3 mtm-85 -95.85 12.37 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.018 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.448 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 1.2 mpt? -138.03 141.39 40.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.035 0.445 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 20.2 pt-20 -65.48 -43.72 89.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.404 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 14.0 pttm -55.66 -44.62 77.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.2 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.85 -42.38 99.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.025 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -62.93 -41.69 99.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.377 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -60.02 -45.42 92.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.572 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.89 -42.57 99.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.254 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 27.7 t-105 -62.58 -45.96 90.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.384 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -57.54 -43.49 84.45 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.252 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.24 -43.05 99.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.591 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.09 80.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.942 0.401 . . . . 0.0 110.342 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.635 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 76.3 mt-30 -61.65 -38.66 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.349 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.536 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 60.1 ttm-85 -60.57 -42.16 96.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.384 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.0 mt -69.55 -30.15 67.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.732 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.635 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 24.7 m80 65.99 118.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.743 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -138.07 154.46 74.21 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.859 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.31 154.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 122.718 2.279 . . . . 0.0 112.364 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.67 -48.7 0.38 Allowed 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.617 2.211 . . . . 0.0 112.403 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.543 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 71.7 t -61.67 -48.65 87.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.435 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.7 ttp85 -65.04 -41.67 94.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.402 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.47 -42.4 99.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.619 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.82 88.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.414 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.543 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 3.7 mp0 -67.91 -41.22 83.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.652 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.7 tp -61.84 -48.33 81.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.154 0.502 . . . . 0.0 110.622 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.2 -41.44 96.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.59 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -57.92 -48.61 79.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.603 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -55.75 -48.97 74.34 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.94 0.4 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.9 mt -58.25 -39.78 80.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.153 0.501 . . . . 0.0 109.833 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.81 -38.42 85.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.59 HG12 ' O ' ' A' ' 47' ' ' ALA . 37.2 mm -62.3 -42.57 95.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.671 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -57.38 -50.85 71.67 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.471 179.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.679 ' OE2' ' NH2' ' A' ' 21' ' ' ARG . 82.2 tt0 -55.24 -49.25 72.49 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.444 0.64 . . . . 0.0 110.296 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -60.73 -42.74 97.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.314 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -62.02 -38.24 87.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.4 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.45 -49.23 76.93 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.89 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 14.8 mt -61.32 -42.25 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.456 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -41.78 97.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.49 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -60.67 -41.42 95.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.291 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -58.88 -46.01 88.84 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -59.53 -43.29 93.5 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.85 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.05 -37.51 87.47 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.009 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -57.55 -45.6 84.92 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.867 179.142 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.408 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.527 0.805 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -70.28 -35.27 73.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.856 0.36 . . . . 0.0 110.332 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -64.75 -52.28 57.81 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.129 0.49 . . . . 0.0 110.583 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 22.4 pt-20 -62.65 -38.94 92.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.979 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.47 -42.31 91.73 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.323 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.8 ttt-85 -63.64 -43.52 96.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -63.73 -42.98 97.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.366 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.82 -44.47 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.192 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.418 ' NE ' ' HA ' ' A' ' 79' ' ' ARG . 3.3 mmp_? -59.83 -42.03 92.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.256 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.44 ' O ' HG13 ' A' ' 84' ' ' ILE . 92.6 m-20 -63.57 -39.85 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.294 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.414 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.83 -48.15 82.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.277 0.561 . . . . 0.0 110.171 -179.491 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.77 -38.16 88.3 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.412 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 53.6 t -63.71 -46.24 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.424 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.9 mt -59.67 -51.32 74.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.473 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.31 -42.47 92.99 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.062 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.51 99.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.809 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -62.83 -49.22 75.76 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.564 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -67.6 -27.76 67.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.032 179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 72.97 25.51 73.53 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.0 mt . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.248 . . . . 0.0 110.75 179.977 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.235 0.339 0 CA-C-O 121.013 0.435 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.554 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 95.7 mt-10 -61.6 -39.41 91.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.573 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.623 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.6 mtmt -61.06 -42.4 98.42 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.409 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.49 -48.02 79.37 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.273 0.559 . . . . 0.0 111.88 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 19.1 t-105 -61.98 -48.42 80.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.426 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.554 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.6 m-70 -69.26 -29.92 67.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.335 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.623 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.5 tptt -58.58 -52.01 67.48 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.894 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.26 -46.46 49.82 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -52.0 -47.43 64.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.669 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.2 m -82.87 -43.98 15.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.863 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.574 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 20.6 m -44.53 -28.92 0.64 Allowed 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.155 -178.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -158.29 -96.84 0.12 Allowed Glycine 0 N--CA 1.46 0.284 0 C-N-CA 119.626 -1.273 . . . . 0.0 111.356 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.54 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.7 mttt -155.98 21.3 0.38 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.745 ' HA ' ' HG3' ' A' ' 134' ' ' GLU . 2.9 m-85 -62.45 49.44 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.907 -178.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.54 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.0 OUTLIER -112.39 110.77 21.17 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.378 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 133.31 -98.8 0.35 Allowed Glycine 0 CA--C 1.53 0.988 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.816 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.2 mm-40 -81.85 -44.05 17.41 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.495 -0.415 . . . . 0.0 111.31 -179.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.857 ' CD ' ' H ' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -63.73 -46.11 86.85 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 130' ' ' PHE . 0.5 OUTLIER -62.44 -41.9 99.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.097 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -62.98 -37.1 85.79 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.468 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 59.3 mttp -61.69 -43.11 99.49 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.324 0.583 . . . . 0.0 109.839 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.445 ' N ' HD22 ' A' ' 138' ' ' LEU . 2.7 mm? -59.47 -43.68 93.18 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.95 -37.38 87.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.619 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -51.38 -42.07 61.12 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . 0.584 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 6.0 mp0 -68.55 -45.47 72.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.374 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -56.6 -52.74 63.69 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.357 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.59 -39.94 89.94 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.238 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.8 m170 -55.5 -40.87 72.29 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.481 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -64.97 -41.72 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.786 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -60.19 -48.89 79.81 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.763 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 18.5 pt-20 -70.93 -46.28 62.73 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.512 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.471 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 68.1 mttm -61.57 -43.2 99.3 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.542 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 43.4 t -64.65 -43.84 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.731 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.596 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.2 m170 -62.7 -36.18 82.13 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.452 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.04 -48.04 75.25 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.55 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -67.96 -42.17 81.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.933 0.397 . . . . 0.0 110.432 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -69.45 -45.87 68.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.015 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.596 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 71.6 t -62.71 -46.47 96.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.064 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 26.3 mt . . . . . 0 C--N 1.327 -0.41 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.575 179.645 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 . . . . . 0 CA--C 1.52 -0.208 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.473 ' N ' HD12 ' A' ' 190' ' ' LEU . 10.6 mp -62.27 -45.08 94.87 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.597 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.487 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.11 -39.16 82.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.094 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 5.2 tm-20 -67.97 -46.05 72.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.084 0.469 . . . . 0.0 111.638 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.457 ' HG2' ' H ' ' A' ' 194' ' ' LEU . 17.6 pttt -74.6 -44.5 50.39 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.325 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.525 ' HG ' ' N ' ' A' ' 195' ' ' ARG . 0.4 OUTLIER -67.15 -41.01 86.77 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.939 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.525 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -67.27 -35.58 79.79 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.603 ' O ' ' HG3' ' A' ' 199' ' ' GLN . 73.8 m -62.25 -40.74 97.18 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.7 -44.26 89.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.357 0.599 . . . . 0.0 109.723 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -64.18 -47.46 79.74 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.436 0.636 . . . . 0.0 110.389 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.603 ' HG3' ' O ' ' A' ' 196' ' ' SER . 0.0 OUTLIER -64.58 -29.62 70.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.052 179.514 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -64.6 -43.56 96.29 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 28.2 mt -63.6 -41.88 98.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.045 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.523 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.23 -36.21 83.35 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.368 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.4 -41.86 99.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.508 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.9 mt -61.43 -40.54 94.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.294 179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.424 ' O ' ' OG ' ' A' ' 208' ' ' SER . 79.4 mtt85 -63.45 -41.13 98.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.959 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.719 ' O ' ' N ' ' A' ' 210' ' ' GLN . 78.9 mtp85 -64.13 -38.94 92.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.288 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.588 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -64.17 -43.11 97.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.024 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.443 ' HG ' ' N ' ' A' ' 209' ' ' HIS . 78.0 p -62.97 -37.31 86.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.683 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . 0.443 ' N ' ' HG ' ' A' ' 208' ' ' SER . 24.1 m170 -94.61 -38.46 10.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.379 -179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.719 ' N ' ' O ' ' A' ' 206' ' ' ARG . 39.6 tt0 -93.89 -32.97 13.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.739 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.588 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.438 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 . . . . . 0 CA--C 1.53 0.185 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 221' ' ' PRO . 0.5 OUTLIER -59.31 178.67 0.22 Allowed Pre-proline 0 N--CA 1.466 0.353 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.619 -179.315 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 220' ' ' GLU . 59.3 Cg_endo -84.11 88.42 1.06 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.597 2.198 . . . . 0.0 112.801 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -141.25 -105.65 0.15 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.441 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.422 ' CG1' ' N ' ' A' ' 224' ' ' ILE . 14.9 p -61.74 -46.6 96.17 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 CA-C-O 121.79 0.805 . . . . 0.0 110.046 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.422 ' N ' ' CG1' ' A' ' 223' ' ' VAL . 0.2 OUTLIER -61.56 -32.86 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.672 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . 0.572 ' O ' HD23 ' A' ' 229' ' ' LEU . 56.1 t0 -64.25 -40.56 96.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.541 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.6 tp -56.04 -42.42 76.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . 0.454 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 27.5 m0 -62.65 -33.92 76.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.736 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . 0.65 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 92.7 m-20 -59.31 -39.12 82.06 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.572 HD23 ' O ' ' A' ' 225' ' ' ASP . 4.1 mm? -65.67 -40.27 92.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.725 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.531 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -25.42 -66.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.301 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.65 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 0.3 OUTLIER -25.48 -87.48 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.726 179.862 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 58.9 m -79.26 45.95 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.738 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -139.51 81.59 1.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.835 0.35 . . . . 0.0 110.54 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 60.38 59.54 2.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.374 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 76.8 mt -141.13 157.57 45.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.997 0.427 . . . . 0.0 110.783 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 74.8 p -83.34 -162.35 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.674 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . 0.507 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 34.9 p-10 -91.75 -53.72 4.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.101 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . 0.507 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 63.8 mttp -61.02 -45.59 94.18 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.25 0.547 . . . . 0.0 110.689 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -62.16 -27.17 68.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.556 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.26 -46.1 85.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.589 -179.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -66.99 -44.05 81.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.363 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -57.96 -51.1 71.06 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.337 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.456 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.97 -45.02 95.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.51 179.424 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.4 ttt-85 -51.85 -57.53 9.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.403 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -62.08 -35.54 78.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.675 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.23 -53.02 63.02 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.23 0.538 . . . . 0.0 110.445 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.2 mm? -63.21 -41.42 99.14 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.728 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.56 -37.63 78.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.386 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -65.48 -65.01 0.73 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.493 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . 0.565 ' CE2' ' CE1' ' A' ' 307' ' ' HIS . 76.2 m-85 -60.46 -40.75 92.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.701 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.542 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.9 tp10 -57.9 -42.04 83.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.285 0.564 . . . . 0.0 109.883 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.33 -35.75 80.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.236 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -60.88 -47.63 85.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.834 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.46 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.2 tt -65.36 -38.13 81.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.174 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.79 -48.36 80.99 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 121.213 0.53 . . . . 0.0 110.468 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.03 -41.46 99.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.065 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . 0.523 ' NE2' ' CD ' ' A' ' 261' ' ' GLN . 0.0 OUTLIER -56.71 -46.16 81.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.955 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . 0.501 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 49.7 t30 -60.13 -40.99 91.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.24 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . 0.457 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -57.66 -45.08 86.02 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.258 0.552 . . . . 0.0 109.859 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.02 -37.01 85.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.292 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.523 ' CD ' ' NE2' ' A' ' 257' ' ' HIS . 82.2 mt-30 -58.23 -44.17 88.12 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.205 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.63 -47.25 86.25 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.115 0.483 . . . . 0.0 109.811 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . 0.457 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 5.5 mp0 -65.33 -31.89 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.021 179.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.04 -42.52 99.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.108 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 -65.99 -49.02 69.29 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.142 0.496 . . . . 0.0 110.474 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.62 -43.32 98.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.09 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.25 81.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.083 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -61.14 -48.41 81.76 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.25 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.93 -45.07 95.32 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.132 0.491 . . . . 0.0 110.398 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.15 -39.73 91.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.398 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.35 -43.75 96.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.037 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -60.31 -43.5 96.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.079 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -67.88 -40.76 83.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.826 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.33 86.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.948 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -55.84 -22.62 26.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.455 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 17.2 m -61.83 -39.06 90.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.65 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 77.9 t -60.85 -45.47 98.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.605 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 108.84 -6.79 33.14 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -55.34 99.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.81 0.338 . . . . 0.0 110.496 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.7 -40.24 95.71 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.41 -46.32 89.14 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.729 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -68.94 -41.9 77.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.808 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.35 -45.28 96.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 32.4 m -60.69 -45.86 92.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.058 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.86 -43.82 87.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.537 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 42.3 t -62.42 -43.66 98.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.585 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -64.26 -40.21 95.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.694 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -60.53 -51.49 69.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.162 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -66.02 -34.24 77.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.105 179.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -57.39 -52.05 66.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.601 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.67 -38.41 83.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 2.2 tp -61.64 -46.91 87.76 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.237 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 41.9 tp -64.22 -42.85 96.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.202 0.525 . . . . 0.0 110.102 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.519 ' O ' ' OG1' ' A' ' 297' ' ' THR . 2.3 tm-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.79 -42.47 99.75 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -60.76 -43.54 97.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.473 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.519 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 76.7 p -58.97 -47.18 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.076 0.465 . . . . 0.0 110.358 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -62.35 -44.39 96.58 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.488 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -62.43 -37.5 86.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.022 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -44.18 97.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.983 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.51 96.28 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . 0.528 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 51.0 t80 -60.82 -45.83 92.93 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.245 0.545 . . . . 0.0 110.372 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.1 m -61.37 -44.75 96.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.461 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.96 -42.24 88.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.112 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.82 -54.92 40.89 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.058 0.456 . . . . 0.0 110.663 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . 0.528 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 75.4 mttt -61.22 -41.35 96.71 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.19 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.565 ' CE1' ' CE2' ' A' ' 250' ' ' PHE . 2.6 t-80 -64.76 -31.17 72.27 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.26 -48.35 81.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.178 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.62 -42.47 86.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.712 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.9 -47.21 85.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . 0.4 HD11 ' HD1' ' A' ' 307' ' ' HIS . 26.8 mt -64.12 -40.51 96.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.74 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.1 t -59.7 -44.68 93.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.11 61.8 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -62.43 -45.6 92.37 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -70.34 -40.52 77.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.133 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.8 t -44.37 -48.08 9.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.055 0.455 . . . . 0.0 110.156 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 12.5 ptp85 . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.036 -178.037 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 . . . . . 0 N--CA 1.465 0.293 0 CA-C-O 120.755 0.312 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -89.61 10.99 21.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.971 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.3 mmm -142.89 141.39 31.51 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 111.062 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -63.86 -35.6 81.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.39 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -59.69 -47.96 83.56 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.017 0.437 . . . . 0.0 110.458 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.65 -37.88 88.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.47 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.43 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 48.9 t-20 -63.32 -40.72 98.12 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.347 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.61 -44.27 96.73 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.604 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.91 -42.61 99.29 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.049 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -61.56 -43.66 98.45 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.222 0.534 . . . . 0.0 110.459 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -58.4 -44.52 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.047 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.52 -41.32 97.15 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.523 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.97 87.24 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.055 0.455 . . . . 0.0 110.224 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.42 -38.03 88.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.285 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -60.3 -43.15 96.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.313 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -65.0 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.227 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 66.27 112.13 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.817 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.1 mt -132.43 154.73 81.67 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.798 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -39.41 158.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.396 0 C-N-CA 122.768 2.312 . . . . 0.0 112.264 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -68.72 -46.57 1.7 Allowed 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 122.621 2.214 . . . . 0.0 112.3 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.96 -47.73 91.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.53 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -65.64 -39.2 91.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.349 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.85 -43.65 98.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.712 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -41.54 95.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.421 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -67.17 -45.19 77.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.98 -49.88 72.95 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.157 0.503 . . . . 0.0 110.641 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -60.96 -40.55 93.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.247 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.64 -40.66 92.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.374 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.07 -47.99 83.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.51 -40.31 96.34 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.543 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -58.29 -45.61 87.61 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.154 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -62.99 -42.61 97.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -51.89 -42.42 62.71 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -64.32 -44.52 91.3 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.783 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.401 ' O ' ' HD3' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -61.61 -44.76 96.4 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.44 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -61.27 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.483 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -57.79 -49.14 77.63 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.815 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -61.27 -42.27 98.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.334 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.53 -46.46 88.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.558 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.8 t90 -57.75 -40.6 80.09 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -58.74 -46.3 87.71 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.939 179.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -60.67 -44.63 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.424 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.47 ' CD2' ' HZ1' ' A' ' 73' ' ' LYS . 8.1 mp -61.51 -41.47 97.36 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.001 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.17 -39.27 85.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 C--N 1.329 -0.294 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.808 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.73 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -57.32 -38.3 73.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.798 0.332 . . . . 0.0 110.278 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.47 ' HZ1' ' CD2' ' A' ' 62' ' ' LEU . 99.3 mttt -61.35 -45.58 93.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.138 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 tp10 -60.28 -40.28 89.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.004 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.56 91.55 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -62.78 -36.58 83.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.439 ' C ' ' CD2' ' A' ' 77' ' ' LEU . 7.8 tt -61.78 -47.36 85.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.351 179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -44.85 96.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.269 0.557 . . . . 0.0 109.75 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -57.4 -42.92 83.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.946 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.445 ' O ' HG13 ' A' ' 84' ' ' ILE . 50.4 t30 -62.56 -39.64 94.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.597 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -49.5 76.67 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.765 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -64.0 -39.41 94.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.223 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.1 t -61.49 -45.37 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.454 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.6 mt -59.2 -50.72 78.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.246 -179.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.13 -40.9 95.08 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.839 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.63 94.38 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.904 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 47.7 tttp -63.88 -47.94 78.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.629 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.2 -23.3 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.951 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 70.22 27.47 72.8 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt . . . . . 0 C--N 1.331 -0.199 0 CA-C-O 120.873 0.368 . . . . 0.0 110.458 179.779 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.463 0.218 0 CA-C-O 120.8 0.333 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.616 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 54.2 mt-10 -64.05 -33.94 76.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.978 0.418 . . . . 0.0 110.648 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.587 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 67.9 mmtt -59.79 -46.91 87.74 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.448 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 31.0 mt -69.09 -47.45 65.2 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.428 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 9.7 t-105 -59.71 -48.7 80.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.247 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.616 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 8.7 m-70 -69.68 -31.16 69.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.207 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.9 tptt -57.19 -51.19 70.33 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.806 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.38 -47.23 51.04 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 119.453 -0.899 . . . . 0.0 110.744 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 48.7 tttm -53.33 -51.03 63.72 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.816 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -74.54 -42.68 58.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.358 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -44.41 -27.81 0.48 Allowed 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.28 -96.46 0.11 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 119.609 -1.281 . . . . 0.0 111.506 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.685 ' O ' ' N ' ' A' ' 131' ' ' SER . 57.4 mttp -155.14 24.73 0.42 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.463 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.4 m-30 -59.48 50.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.451 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.685 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.8 m -107.52 113.26 26.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.199 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 120.98 -97.04 0.62 Allowed Glycine 0 CA--C 1.526 0.774 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.828 178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.491 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 5.6 mp0 -74.41 -43.99 53.87 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.441 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.602 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 51.8 mp0 -63.0 -51.88 65.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.32 -40.26 95.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.935 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -61.66 -41.21 97.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.7 mttt -62.36 -44.05 97.39 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.05 0.452 . . . . 0.0 110.322 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mt -59.53 -43.73 93.38 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.544 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.2 OUTLIER -67.88 -33.82 75.48 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.562 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 71.7 mtp85 -53.93 -45.48 71.25 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 118.866 -1.134 . . . . 0.0 108.131 178.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.51 -37.19 71.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.604 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.544 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.6 m-85 -58.64 -58.16 9.78 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.821 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.97 -41.47 98.05 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.413 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.562 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 48.1 m170 -56.02 -42.62 76.76 Favored 'General case' 0 N--CA 1.46 0.065 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.678 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.496 ' O ' ' CG2' ' A' ' 149' ' ' VAL . 9.5 m-70 -65.82 -39.99 91.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.787 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.439 ' O ' HG21 ' A' ' 149' ' ' VAL . 51.2 mtpt -59.43 -45.29 91.97 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.257 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -71.54 -46.86 58.38 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.625 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 68.2 mttm -62.69 -46.04 89.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.751 0.31 . . . . 0.0 111.282 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . 0.496 ' CG2' ' O ' ' A' ' 145' ' ' HIS . 17.7 m -65.77 -37.85 80.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.597 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.603 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.2 m170 -65.28 -41.58 94.03 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.74 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.82 -45.26 93.44 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.631 ' CE1' ' NZ ' ' A' ' 193' ' ' LYS . 23.1 m-85 -69.54 -47.31 64.12 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -65.62 -40.79 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.643 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.603 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 56.6 t -64.05 -43.7 97.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.711 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.448 179.619 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 . . . . . 0 CA--C 1.519 -0.25 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 10.5 mt -60.96 -41.47 96.39 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.546 -0.462 . . . . 0.0 109.998 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.19 -35.02 77.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.16 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 86.0 tt0 -67.8 -44.93 76.18 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.153 0.501 . . . . 0.0 111.622 -178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.631 ' NZ ' ' CE1' ' A' ' 152' ' ' TYR . 0.0 OUTLIER -71.87 -38.75 69.99 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.064 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.55 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -65.15 -41.9 94.3 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.969 -0.693 . . . . 0.0 110.351 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.493 ' HG2' ' O ' ' A' ' 192' ' ' GLU . 18.8 ptp180 -65.27 -38.14 89.36 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.55 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 79.1 p -60.87 -39.03 87.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 193' ' ' LYS . 97.1 mt -63.72 -42.78 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -58.49 -41.52 85.52 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -60.37 -38.6 84.4 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . 0.407 ' O ' ' HB3' ' A' ' 203' ' ' ARG . . . -60.1 -40.3 96.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 19.8 mt -62.16 -40.59 96.51 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.012 -0.675 . . . . 0.0 109.742 178.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -60.31 -37.42 80.51 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.407 ' HB3' ' O ' ' A' ' 200' ' ' GLY . 5.2 tmm_? -60.84 -41.38 95.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.461 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.18 -38.17 82.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -61.08 -42.54 98.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.284 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 210' ' ' GLN . 5.7 mmp_? -64.48 -36.14 83.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.327 179.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.698 ' O ' ' N ' ' A' ' 211' ' ' GLY . 25.2 t -63.02 -44.95 99.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.194 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.59 -26.79 62.75 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.559 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . 0.426 ' ND1' ' NH1' ' A' ' 206' ' ' ARG . 45.1 t-80 -94.23 -12.93 27.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.372 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.3 tt0 -136.86 -38.33 0.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.093 0.473 . . . . 0.0 110.442 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.698 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.589 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.569 ' HG2' ' H ' ' A' ' 220' ' ' GLU . 37.8 tt0 . . . . . 0 N--CA 1.442 -0.849 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.569 ' H ' ' HG2' ' A' ' 219' ' ' GLU . 16.9 tp10 63.43 125.41 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -48.02 121.21 5.66 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 121.38 1.387 . . . . 0.0 112.811 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 178.69 -102.52 0.0 OUTLIER 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.146 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.62 -48.93 86.51 Favored 'Isoleucine or valine' 0 C--O 1.249 1.035 0 CA-C-O 121.704 0.764 . . . . 0.0 110.763 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -31.47 53.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.438 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 51.9 t0 -64.36 -37.99 89.46 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.4 tp -59.44 -42.84 92.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 45.9 m0 -60.36 -36.45 78.06 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.045 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 225' ' ' ASP . 94.0 m-20 -59.43 -40.93 88.33 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' A' ' 231' ' ' GLN . 8.8 mp -63.91 -40.67 97.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.321 0.582 . . . . 0.0 109.512 179.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -53.04 -8.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.846 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.542 ' OE1' ' NH2' ' A' ' 244' ' ' ARG . 11.4 tp-100 -62.86 -43.73 98.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.795 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 54.0 p -145.0 16.48 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.576 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -59.67 -49.86 76.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.697 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . 0.515 ' N ' ' ND2' ' A' ' 234' ' ' ASN . 0.1 OUTLIER 177.54 77.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.595 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 96.1 mt -137.19 161.89 34.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.674 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.0 p -72.95 -162.44 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.617 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -92.19 -55.58 3.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -61.93 -41.34 97.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.985 0.421 . . . . 0.0 110.335 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -63.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.81 -43.02 99.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.162 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -64.27 -49.44 71.87 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.856 0.36 . . . . 0.0 110.775 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.44 -39.77 94.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.978 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.5 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -68.01 -42.6 80.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.345 179.089 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . 0.542 ' NH2' ' OE1' ' A' ' 231' ' ' GLN . 59.2 ttm-85 -59.17 -50.17 75.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.976 -178.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.3 -40.61 86.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.791 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -62.07 -46.93 86.95 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.162 0.506 . . . . 0.0 110.415 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 251' ' ' GLU . 1.0 OUTLIER -62.02 -41.68 98.35 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.171 179.49 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.04 -42.88 81.3 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.119 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 13.6 m170 -59.42 -55.79 30.22 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.664 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -63.66 -33.85 76.54 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.694 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 29.3 tp10 -59.72 -43.33 94.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.053 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.44 86.65 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.398 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -59.9 -48.17 82.8 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.705 -179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.402 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.3 tt -66.47 -31.76 55.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.272 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.32 -48.87 79.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.186 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.14 -42.25 99.44 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.372 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -57.64 -42.77 84.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.127 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.56 -40.43 96.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.356 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . 0.403 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 13.7 t-160 -58.38 -48.06 81.83 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.239 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -62.81 -37.08 85.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.482 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.432 ' NE2' HG23 ' A' ' 297' ' ' THR . 0.3 OUTLIER -59.17 -45.5 90.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.789 0.328 . . . . 0.0 110.435 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -61.73 -45.43 93.99 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . 0.403 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.8 mp0 -64.94 -34.92 79.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.988 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.16 -43.12 99.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.335 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -65.31 -48.22 73.84 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.992 0.425 . . . . 0.0 110.66 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 66.5 mt -63.14 -43.33 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.128 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.07 -36.94 83.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.23 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -63.03 -46.59 86.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.378 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.98 -44.55 95.74 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.453 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.41 -42.87 99.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.465 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 2.7 tt -60.72 -43.9 97.28 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.752 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -58.66 -44.75 90.25 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.165 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 -67.75 -36.01 79.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.626 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -62.96 -37.11 85.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.009 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -58.84 -17.06 20.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.396 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 60.4 p -89.3 2.62 54.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.68 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 14.8 p -60.18 -43.48 93.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.677 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.412 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 119.67 -67.86 0.39 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -88.61 116.91 27.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.781 0.324 . . . . 0.0 110.349 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -64.95 116.05 8.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -145.34 -44.62 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.7 0.286 . . . . 0.0 110.408 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . 0.412 ' O ' ' OG ' ' A' ' 286' ' ' SER . 11.6 ptp180 -105.76 -6.18 19.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.457 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.55 -45.8 96.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.528 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 284' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 288' ' ' GLU . 44.5 t -63.49 -51.63 64.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.513 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.82 -44.44 96.83 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.981 0.419 . . . . 0.0 110.853 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 286' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 282' ' ' ARG . 38.6 m -60.32 -42.99 96.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.382 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -63.54 -38.33 90.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.933 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 284' ' ' SER . 76.0 mm-40 -59.89 -61.45 2.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 29.4 mmtt -63.4 -39.71 95.24 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.018 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -45.16 -55.41 5.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.938 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -65.43 -35.69 81.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.679 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 16.5 tp -60.63 -49.04 79.14 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.497 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.67 -41.52 98.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 109.973 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -39.94 95.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -59.99 -50.78 63.99 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . 0.433 ' CZ ' ' OE1' ' A' ' 299' ' ' GLU . 10.6 tpp180 -60.4 -37.79 81.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.909 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.432 HG23 ' NE2' ' A' ' 261' ' ' GLN . 9.1 m -58.91 -48.15 82.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.327 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -63.59 -41.53 98.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.729 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . 0.433 ' OE1' ' CZ ' ' A' ' 296' ' ' ARG . 96.6 mt-10 -58.77 -43.82 90.49 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.138 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.5 -43.99 97.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.393 -0.523 . . . . 0.0 109.906 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.75 -41.9 84.07 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -61.16 -45.88 92.83 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.145 0.498 . . . . 0.0 110.455 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.5 m -60.14 -43.37 95.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.313 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.36 -43.12 93.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.052 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -58.66 -46.12 87.85 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.805 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.99 -42.86 99.96 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.559 179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -65.42 -35.42 80.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.137 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . 0.454 ' O ' ' OG ' ' A' ' 312' ' ' SER . 21.7 mt -62.29 -43.58 98.5 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.362 179.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 19.5 tm0? -65.49 -46.52 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -64.31 -49.02 73.43 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.079 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 33.1 mt -62.86 -42.78 99.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 312' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 51.0 m -60.95 -41.87 97.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.299 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.48 98.22 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.3 -47.99 79.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.773 0.32 . . . . 0.0 110.74 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . 0.481 ' O ' ' C ' ' A' ' 316' ' ' SER . 17.0 mt -77.71 -25.4 14.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 315' ' ' ILE . 42.6 t -33.1 -54.59 0.39 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.742 -179.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.2 ptt85 . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.484 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 120.698 0.285 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -81.1 -15.43 55.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.936 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.04 145.85 51.15 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 121.401 0.62 . . . . 0.0 111.166 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -64.99 -36.51 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.363 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.1 tttp -57.57 -47.93 80.76 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.276 0.56 . . . . 0.0 110.466 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.3 mt -60.8 -39.47 89.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.344 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -63.47 -39.84 95.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -57.41 -48.91 77.86 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.373 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.431 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 4.2 mm? -61.38 -42.82 99.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.23 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.501 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 46.5 t-105 -61.48 -42.35 98.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.266 0.555 . . . . 0.0 110.417 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -57.72 -44.6 86.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.403 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.8 -41.57 95.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.356 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.27 93.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.428 . . . . 0.0 110.427 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.501 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.5 mt-30 -62.46 -39.42 93.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.329 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.24 -40.92 97.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.361 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.02 -39.86 95.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.429 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.64 106.94 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.896 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -129.45 155.06 80.73 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -40.47 154.33 0.06 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.65 2.233 . . . . 0.0 112.245 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.93 -36.07 32.35 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.594 2.196 . . . . 0.0 112.296 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.73 -49.77 75.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.017 0.437 . . . . 0.0 110.747 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -68.25 -39.29 82.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.464 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -63.03 -43.41 98.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.88 -43.67 87.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.634 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.57 -44.26 74.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.765 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.63 -48.4 79.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.565 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -60.88 -41.63 96.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.35 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.61 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.69 -48.79 79.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.734 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -56.37 -47.92 77.9 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.536 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.64 -39.25 83.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.075 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.98 -38.07 84.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.95 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.61 HG12 ' O ' ' A' ' 47' ' ' ALA . 38.6 mm -62.92 -44.38 99.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.899 179.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -58.31 -43.64 88.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.332 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -60.52 -47.48 85.98 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.171 0.51 . . . . 0.0 110.322 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -62.59 -41.33 98.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.693 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -63.87 -37.33 86.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.301 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -62.63 -46.99 85.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.103 0.477 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.1 tp -61.4 -41.32 96.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.995 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.04 -41.99 99.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.532 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -58.96 -43.35 91.3 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.924 0.393 . . . . 0.0 110.275 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.78 -45.87 92.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -57.75 -42.42 83.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.997 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.4 mt -62.53 -42.34 99.46 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.016 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -56.48 -43.65 79.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.879 179.017 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.736 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -60.48 -39.18 86.71 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.345 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.465 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 3.4 mptp? -54.79 -55.87 25.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.914 0.388 . . . . 0.0 110.52 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -57.84 -39.89 78.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.021 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.53 -41.38 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.54 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.465 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 89.7 mtm180 -65.16 -39.98 93.7 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.69 -44.91 92.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.392 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.401 HD13 HG23 ' A' ' 78' ' ' ILE . 96.5 mt -65.53 -45.14 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.238 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -60.63 -43.24 97.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.128 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.402 ' O ' HG13 ' A' ' 84' ' ' ILE . 26.0 t-20 -64.06 -40.13 95.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.58 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.435 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.45 -46.68 88.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.045 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -64.92 -39.87 94.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.588 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.8 t -63.75 -46.5 94.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.432 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.467 HD12 HG22 ' A' ' 84' ' ' ILE . 96.6 mt -60.13 -49.88 82.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.558 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.3 mt -65.09 -40.69 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.062 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.01 -41.1 97.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.795 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -64.77 -46.78 80.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.775 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -76.05 -19.59 58.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.394 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 65.29 26.53 71.7 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.9 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 110.669 179.971 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.954 0.407 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.538 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.3 mt-10 -60.51 -39.24 87.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.521 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.571 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.4 mttt -61.0 -44.2 97.77 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.494 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.75 -46.54 84.85 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.943 0.402 . . . . 0.0 111.71 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.425 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 8.7 t-105 -60.0 -47.54 85.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.369 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.538 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.9 m-70 -71.17 -32.97 69.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.429 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.8 OUTLIER -56.59 -51.02 70.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.86 -178.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.63 -46.74 58.22 Favored 'General case' 0 C--O 1.247 0.936 0 C-N-CA 120.017 -0.673 . . . . 0.0 110.596 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -52.97 -45.21 67.69 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.914 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.7 m -85.41 -40.94 15.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.691 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.564 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 13.7 m -44.54 -29.88 0.79 Allowed 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -155.36 -96.59 0.13 Allowed Glycine 0 N--CA 1.463 0.472 0 C-N-CA 119.751 -1.214 . . . . 0.0 111.31 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.731 ' O ' ' N ' ' A' ' 131' ' ' SER . 65.1 mttp -154.51 17.58 0.47 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -57.93 51.04 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.811 -179.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.731 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.5 m -109.13 123.54 49.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.139 0.495 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.61 -97.8 1.2 Allowed Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.142 178.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -74.96 -39.87 61.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.993 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.476 ' O ' HD22 ' A' ' 138' ' ' LEU . 58.5 mp0 -63.45 -52.71 60.28 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.067 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.3 mt -59.8 -39.96 86.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.352 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -61.82 -38.66 88.99 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -63.1 -42.89 99.66 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.444 0.64 . . . . 0.0 109.854 178.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 134' ' ' GLU . 4.2 mm? -59.45 -42.55 92.23 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.21 -37.57 87.94 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -53.54 -41.16 66.15 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 178.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . 0.931 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 79.9 mm-40 -69.66 -47.32 63.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -57.42 -48.75 78.29 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.2 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 95.2 mt -59.76 -41.33 90.78 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.071 -0.651 . . . . 0.0 110.205 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.931 ' ND1' ' O ' ' A' ' 141' ' ' GLU . 1.8 p-80 -55.84 -43.03 76.65 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.024 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.706 ' N ' ' CD2' ' A' ' 144' ' ' HIS . 11.9 m-70 -59.8 -41.98 92.42 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.449 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -62.65 -42.44 99.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.313 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.718 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 96.5 mt-10 -67.59 -44.09 78.95 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.206 0.527 . . . . 0.0 111.297 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.47 -42.24 71.71 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.146 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.99 -50.56 76.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.718 ' CD2' ' O ' ' A' ' 147' ' ' GLU . 0.2 OUTLIER -72.75 -18.89 61.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.25 -179.642 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.671 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 9.7 mm-40 -70.89 -48.69 52.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.502 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 29.2 m-85 -63.77 -41.22 98.02 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.767 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.85 -38.46 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.938 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.49 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 19.3 t -61.25 -46.28 96.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.265 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 C--N 1.324 -0.542 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.814 -179.709 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.455 ' O ' ' CD ' ' A' ' 193' ' ' LYS . 97.5 mt-10 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.833 0.349 . . . . 0.0 110.077 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 3.5 mt -61.23 -42.05 97.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.351 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.411 ' O ' ' HB3' ' A' ' 195' ' ' ARG . 98.3 mttt -68.84 -29.36 67.67 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 76.3 tt0 -69.94 -50.97 36.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.978 0.418 . . . . 0.0 111.629 -179.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.502 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 1.1 ptmt -71.94 -39.41 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.783 -0.367 . . . . 0.0 111.247 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.574 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.45 -41.45 72.82 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.93 -179.493 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.505 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 50.2 ptt85 -65.87 -37.46 86.2 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 96.0 p -62.73 -41.45 99.19 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 193' ' ' LYS . 91.9 mt -65.72 -43.69 93.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.824 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -63.51 -41.27 98.51 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.685 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.855 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 47.1 mm-40 -63.5 -33.02 74.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.207 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.57 -40.6 90.73 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 37.3 mt -63.74 -43.34 96.76 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.205 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.904 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 9.1 p-10 -65.82 -34.23 77.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.595 0.712 . . . . 0.0 109.213 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.904 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.1 tmt_? -63.43 -42.6 98.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.375 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 49.4 mt -61.18 -39.78 91.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 33.6 mmt180 -60.19 -43.1 96.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.045 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.611 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.8 mtm-85 -64.76 -36.79 85.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.391 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.67 ' O ' ' N ' ' A' ' 211' ' ' GLY . 47.2 t -63.17 -46.46 95.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.041 0.448 . . . . 0.0 110.176 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.7 p -74.24 -26.64 60.35 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.928 0.394 . . . . 0.0 110.764 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -95.05 -14.37 24.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.292 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.611 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -138.11 -30.19 0.81 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.043 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.67 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.484 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 . . . . . 0 N--CA 1.447 -0.623 0 CA-C-O 120.856 0.36 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.419 ' O ' ' CG1' ' A' ' 223' ' ' VAL . 39.5 tp10 -174.01 126.77 0.44 Allowed Pre-proline 0 C--O 1.225 -0.19 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.811 176.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.631 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 72.6 Cg_exo -43.42 159.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.377 2.051 . . . . 0.0 111.755 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.631 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 65.8 ttp85 95.74 -54.44 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.619 0.575 . . . . 0.0 110.705 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.84 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 4.9 p -55.91 -83.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.598 0 CA-C-O 121.351 0.596 . . . . 0.0 110.878 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.84 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 0.9 OUTLIER -57.1 -24.58 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.036 -179.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -64.36 -47.55 78.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.096 0.474 . . . . 0.0 109.731 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.35 -42.82 99.31 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.77 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . 0.418 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 43.6 m0 -60.88 -36.17 78.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.983 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 228' ' ' ASP . 64.8 t0 -63.74 -38.3 90.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.663 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 231' ' ' GLN . 95.0 mt -62.62 -42.18 99.43 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.1 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.403 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -38.12 -25.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.095 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 229' ' ' LEU . 7.2 tt0 -69.65 -72.47 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.805 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 79.1 p -66.18 -18.49 65.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -57.4 -53.88 53.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.876 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . 0.659 ' CG ' ' H ' ' A' ' 235' ' ' LEU . 48.5 t-20 -178.79 -143.11 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.046 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . 0.659 ' H ' ' CG ' ' A' ' 234' ' ' ASN . 36.7 mt 80.32 144.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.661 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 24.1 p -80.57 172.47 13.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 33.0 p-10 -55.86 -44.12 77.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.638 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . 0.467 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.6 -47.99 81.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.011 0.434 . . . . 0.0 110.662 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -65.85 -36.11 82.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.68 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.46 -43.12 98.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.196 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -62.9 -48.97 76.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.477 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.17 -48.69 80.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.504 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -63.64 -39.72 95.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.323 179.283 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -57.44 -50.32 73.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.961 0.41 . . . . 0.0 110.528 -179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.61 -36.26 83.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.563 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -60.13 -51.87 67.77 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.51 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.502 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.12 -40.38 97.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.886 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 79.3 tttt -55.65 -45.4 77.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.196 0.522 . . . . 0.0 110.337 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.86 -37.03 81.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.288 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -61.23 -49.33 77.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.065 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 11.9 pt-20 -62.83 -37.08 85.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.058 0.456 . . . . 0.0 109.851 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.83 87.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.617 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -63.53 -48.97 75.36 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.245 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.5 tt -64.2 -34.17 67.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.26 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -63.05 -48.34 79.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.053 0.454 . . . . 0.0 110.399 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.217 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -55.75 -43.2 76.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.029 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -61.83 -40.47 95.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.088 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -59.16 -47.83 83.85 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.249 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -64.24 -32.91 74.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.378 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -48.69 80.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.861 0.363 . . . . 0.0 110.186 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . 0.445 ' HZ3' HD13 ' A' ' 266' ' ' ILE . 65.6 tttm -61.93 -43.54 98.64 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.27 -36.85 85.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.002 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 41.6 tp -62.4 -42.47 99.45 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.137 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -62.41 -46.05 90.34 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.381 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . 0.445 HD13 ' HZ3' ' A' ' 262' ' ' LYS . 88.0 mt -62.51 -43.48 98.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.3 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.2 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.39 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -61.28 -46.96 88.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.211 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -61.93 -46.15 90.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.37 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -62.0 -39.2 91.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.52 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 1.3 tt -60.11 -44.16 95.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.887 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -63.08 -40.19 96.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.271 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -67.33 -41.61 84.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.759 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -62.6 -41.92 99.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.82 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -56.95 -17.56 10.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.94 0.4 . . . . 0.0 110.539 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.6 t -62.6 -34.09 76.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.542 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.655 HG12 ' H ' ' A' ' 279' ' ' ASP . 8.4 p -59.16 -40.03 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.323 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.447 ' H ' HG13 ' A' ' 277' ' ' VAL . . . 64.94 26.93 71.6 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . 0.655 ' H ' HG12 ' A' ' 277' ' ' VAL . 25.6 t0 -108.19 -8.8 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.318 . . . . 0.0 110.556 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . 0.654 ' C ' ' H ' ' A' ' 282' ' ' ARG . . . 63.99 -141.64 45.28 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 78.2 tt0 58.56 -5.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.495 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . 0.654 ' H ' ' C ' ' A' ' 280' ' ' GLY . 41.9 ttm180 -140.02 -31.07 0.66 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.516 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.83 -44.07 98.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.418 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 39.6 t -60.78 -53.15 60.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.08 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 74.0 mtp85 -60.82 -46.63 89.79 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.913 0.387 . . . . 0.0 111.064 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 19.6 m -59.1 -40.24 84.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -65.78 -39.38 90.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.547 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -58.7 -59.65 5.07 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.28 0.562 . . . . 0.0 110.429 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -63.23 -35.84 81.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.309 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -52.16 -49.04 64.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.045 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.66 -31.93 70.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.258 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 16.8 tp -64.25 -53.29 51.46 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.51 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.0 mp -63.6 -41.53 98.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.012 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -64.77 -39.57 93.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.169 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.15 -45.43 96.57 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . 0.628 ' HE ' ' C ' ' A' ' 296' ' ' ARG . 1.4 tmm_? -63.63 -41.88 98.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.058 0.456 . . . . 0.0 110.14 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.1 m -58.45 -49.59 76.78 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.47 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -40.13 96.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.417 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -58.48 -42.67 88.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -44.31 96.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.919 0.39 . . . . 0.0 110.462 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.28 -45.42 92.77 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -62.11 -41.76 98.55 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.098 0.475 . . . . 0.0 110.463 179.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 14.5 m -61.1 -43.97 98.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.502 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -60.03 -43.21 92.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.96 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -59.16 -48.97 79.63 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.196 0.522 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -61.74 -44.8 96.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.226 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.581 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.8 OUTLIER -63.36 -36.05 82.42 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . 0.471 ' O ' ' OG ' ' A' ' 312' ' ' SER . 0.4 OUTLIER -58.0 -45.42 86.85 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.413 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -71.66 -57.63 4.21 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.272 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.34 -49.58 76.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.55 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 4.4 tp -61.55 -43.03 99.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.506 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 312' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 51.8 p -60.0 -40.54 89.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.15 -38.27 95.06 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.24 -45.0 95.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.78 0.324 . . . . 0.0 110.659 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . 0.638 ' O ' ' N ' ' A' ' 317' ' ' ARG . 4.1 mm -61.0 -100.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.454 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.493 ' C ' ' O ' ' A' ' 315' ' ' ILE . 1.4 m 30.54 -87.11 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.309 0.576 . . . . 0.0 110.264 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.638 ' N ' ' O ' ' A' ' 315' ' ' ILE . 11.4 ptp85 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.46 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.481 0.182 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -67.25 -18.77 65.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.88 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.4 mmt -129.6 148.05 51.46 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.295 0.569 . . . . 0.0 111.116 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.669 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 49.7 mp0 -66.42 -40.94 89.86 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.698 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -56.01 -47.79 77.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.121 0.486 . . . . 0.0 110.469 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.59 -39.41 91.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.295 0.569 . . . . 0.0 109.506 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.24 -40.25 95.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.185 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.48 -42.71 96.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.209 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.88 -43.8 98.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.944 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.577 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 56.7 t-105 -61.8 -44.01 97.71 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.293 0.568 . . . . 0.0 110.369 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -56.66 -42.6 79.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.103 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.24 -42.93 99.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.205 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.73 -41.25 90.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.99 0.424 . . . . 0.0 110.274 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.577 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 73.8 mt-30 -58.79 -47.29 85.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.184 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -63.56 -34.77 78.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.19 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 14.4 tp -62.43 -36.64 83.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.284 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.569 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 35.7 m170 65.89 110.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.074 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -134.74 154.19 79.3 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.74 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -40.61 153.92 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 122.562 2.174 . . . . 0.0 112.423 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.86 -50.2 5.59 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.682 2.255 . . . . 0.0 112.457 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.27 -47.82 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.575 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.833 ' NH2' ' HH ' ' A' ' 88' ' ' TYR . 64.8 ttt-85 -63.24 -39.47 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.083 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.89 -44.42 96.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.716 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.63 94.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.401 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.58 -44.99 69.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.3 tp -63.46 -46.87 84.24 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -62.09 -42.27 99.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.37 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.29 90.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.457 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -59.71 -52.56 64.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.495 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.51 -39.73 94.45 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.2 0.524 . . . . 0.0 110.378 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.3 -45.53 87.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.016 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.61 -42.68 96.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.822 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -52.28 -42.93 64.13 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -64.86 -41.31 95.79 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -61.63 -46.71 88.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.241 0.543 . . . . 0.0 110.586 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -63.28 -35.7 81.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.485 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.41 ' OE1' ' C ' ' A' ' 56' ' ' GLU . 10.4 tm-20 -58.14 -47.66 82.65 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.985 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.31 -42.38 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.305 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.03 -44.36 96.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.477 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.5 t90 -59.14 -41.63 88.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -60.16 -45.89 91.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -58.39 -43.28 88.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.977 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -61.91 -39.41 91.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.851 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.35 -41.96 90.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.056 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.432 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.529 0.928 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -68.15 -34.25 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.859 0.362 . . . . 0.0 110.622 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.5 mttt -59.03 -59.05 6.09 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.71 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 13.5 pt-20 -58.76 -39.23 80.39 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.043 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -58.75 -41.43 86.48 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.406 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -64.95 -41.2 95.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.9 0.381 . . . . 0.0 110.07 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.27 -43.9 93.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.253 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 94.2 mt -64.24 -47.49 89.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.07 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -60.42 -44.21 95.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.194 179.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.441 ' O ' HG13 ' A' ' 84' ' ' ILE . 44.9 t30 -61.91 -41.04 97.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.511 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.425 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.01 -50.13 74.48 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.129 -179.427 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -64.93 -37.17 86.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.32 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.78 -45.96 95.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.442 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.01 -51.23 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.464 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.63 -40.36 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.788 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.56 79.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.966 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -61.4 -47.94 83.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.55 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.833 ' HH ' ' NH2' ' A' ' 41' ' ' ARG . 5.7 m-85 -61.95 -30.29 70.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.069 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.02 18.94 80.16 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 51.2 mt . . . . . 0 C--N 1.331 -0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.323 179.915 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.936 0.398 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.538 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.7 mt-10 -61.67 -38.13 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.579 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.606 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 63.7 mttp -61.22 -45.74 93.31 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.54 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 41.5 mt -64.13 -46.15 85.43 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.913 0.387 . . . . 0.0 111.888 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 18.0 t-105 -57.8 -49.38 76.82 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.755 -179.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.538 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 7.7 m-70 -72.76 -31.99 65.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.46 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.606 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 1.0 OUTLIER -54.82 -51.52 65.59 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.73 -179.109 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.71 -46.59 52.9 Favored 'General case' 0 C--O 1.247 0.924 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.69 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 49.7 tttm -50.34 -41.59 51.6 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.781 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.5 m -95.08 -38.14 10.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.95 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -45.45 -27.34 0.7 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.961 0.41 . . . . 0.0 109.952 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.79 -92.26 0.09 OUTLIER Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.339 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -162.79 25.1 0.1 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.361 0.6 . . . . 0.0 109.525 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.414 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 8.7 m-85 -69.76 51.06 0.11 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.378 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 2.0 m -106.48 139.11 41.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.25 0.548 . . . . 0.0 111.747 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 89.12 -98.11 2.4 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.589 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 81.6 mm-40 -72.96 -43.83 61.83 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.96 -179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -61.27 -49.35 77.42 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.304 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 130' ' ' PHE . 1.5 mt -59.73 -40.4 87.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.306 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.56 -41.01 98.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.026 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.8 mttt -60.56 -42.75 97.24 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 121.387 0.613 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.403 HD22 ' N ' ' A' ' 138' ' ' LEU . 3.0 mm? -59.71 -42.96 94.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.29 94.26 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.834 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -51.69 -41.64 61.6 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.65 -40.89 76.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.508 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -60.38 -52.43 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.429 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.36 -41.09 92.98 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.247 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -53.88 -46.69 71.41 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.51 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.44 ' O ' ' CG2' ' A' ' 149' ' ' VAL . 9.3 m-70 -61.37 -40.58 94.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.441 ' O ' HG23 ' A' ' 149' ' ' VAL . 16.9 mmtt -59.37 -43.67 92.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.343 -179.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 143' ' ' LEU . 3.7 mp0 -70.7 -46.88 62.3 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.553 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.5 mttp -62.15 -47.05 86.26 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.12 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 146' ' ' LYS . 26.1 m -65.59 -37.13 79.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.02 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.577 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -63.81 -41.19 97.94 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.416 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -65.47 -45.65 82.87 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.332 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -62.86 -47.25 84.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 110.616 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -70.54 -46.61 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.226 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.577 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 75.6 t -62.27 -46.06 97.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.702 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.4 mt . . . . . 0 C--N 1.324 -0.536 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.447 -179.443 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 . . . . . 0 CA--C 1.521 -0.151 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.525 ' N ' HD12 ' A' ' 190' ' ' LEU . 9.7 mp -63.26 -44.21 95.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 62.5 mttp -67.87 -40.0 83.64 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -68.66 -50.56 50.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.839 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.432 ' HG2' ' H ' ' A' ' 194' ' ' LEU . 2.6 pttm -67.09 -42.93 83.79 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.202 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.542 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.74 -37.84 76.62 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.47 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.508 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 11.6 mmm180 -63.4 -39.87 95.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 58.1 m -62.02 -42.59 99.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.77 -44.09 96.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.786 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -62.78 -40.98 99.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.522 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.58 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 95.2 mt-30 -62.03 -37.91 86.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.293 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.82 -41.48 98.82 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.7 mt -63.82 -40.56 96.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.009 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -61.91 -38.17 87.39 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.413 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -63.45 -42.63 98.64 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.678 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.2 mt -60.56 -40.15 90.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.354 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -64.19 -43.08 96.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.062 179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.732 ' O ' ' N ' ' A' ' 210' ' ' GLN . 95.8 mtt-85 -63.14 -44.67 94.9 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.228 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.7 OUTLIER -64.39 -38.17 81.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.754 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 18.6 m -62.15 -35.7 79.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -103.89 -19.6 14.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.241 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.732 ' N ' ' O ' ' A' ' 206' ' ' ARG . 44.1 tt0 -115.84 -26.0 7.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.441 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 219' ' ' GLU . 81.1 tt0 . . . . . 0 CA--C 1.532 0.269 0 CA-C-O 120.847 0.356 . . . . 0.0 110.645 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.469 ' C ' ' O ' ' A' ' 219' ' ' GLU . 3.7 mp0 -34.86 151.04 0.07 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.663 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -76.2 47.83 2.13 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.488 2.125 . . . . 0.0 112.223 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.475 ' HE ' ' HA ' ' A' ' 222' ' ' ARG . 0.0 OUTLIER -125.86 -82.57 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.798 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.547 HG11 ' H ' ' A' ' 224' ' ' ILE . 0.3 OUTLIER -59.61 -53.37 49.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.495 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.547 ' H ' HG11 ' A' ' 223' ' ' VAL . 0.7 OUTLIER -62.09 -34.96 66.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.356 0.598 . . . . 0.0 109.495 -179.467 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -65.91 -36.39 83.24 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.66 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.34 -43.06 92.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -62.42 -37.85 87.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.738 178.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -58.75 -40.61 84.37 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 231' ' ' GLN . 89.2 mt -62.96 -42.39 99.81 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.75 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.455 ' O ' ' CD1' ' A' ' 235' ' ' LEU . . . -38.96 -27.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 229' ' ' LEU . 17.4 tt0 -60.47 -42.44 96.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.634 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.8 m -125.64 61.66 1.23 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.655 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -127.73 -70.79 0.69 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.551 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -173.31 89.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.846 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . 0.472 ' N ' ' CD1' ' A' ' 235' ' ' LEU . 0.1 OUTLIER -136.01 -156.13 0.69 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.68 -179.679 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 168.49 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.499 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -59.69 -54.55 45.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.858 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.43 -41.77 93.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.172 0.511 . . . . 0.0 110.558 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -59.43 -34.27 72.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.201 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.11 -43.25 99.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.793 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -65.85 -50.6 63.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.535 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.72 89.33 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.132 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.47 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -65.02 -42.13 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.329 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -54.69 -52.93 60.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.983 0.42 . . . . 0.0 110.434 -179.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -65.61 -38.84 90.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.92 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -57.41 -54.14 50.24 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.364 0.602 . . . . 0.0 110.616 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.05 -37.13 85.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.534 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.552 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 43.3 tttp -55.32 -43.0 74.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 110.223 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -70.18 -39.3 75.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.334 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -60.65 -49.29 78.1 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.29 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.597 ' OE1' ' N ' ' A' ' 252' ' ' ALA . 0.1 OUTLIER -62.09 -39.4 92.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . 0.597 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.14 -37.32 85.41 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.536 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -62.74 -48.4 79.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.053 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -37.98 81.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.309 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -59.18 -47.13 86.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.511 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -63.21 -43.34 98.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.293 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . 0.404 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -58.2 -43.81 87.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.361 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . 0.421 ' OD1' ' C ' ' A' ' 258' ' ' ASN . 43.4 t-20 -61.14 -41.54 96.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.344 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -60.58 -48.56 81.24 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.1 0.476 . . . . 0.0 110.529 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -62.7 -34.56 77.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.397 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.525 HE21 ' CG2' ' A' ' 297' ' ' THR . 69.0 mm-40 -62.62 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.219 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.32 -47.72 83.0 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.087 0.47 . . . . 0.0 109.903 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.58 -37.19 86.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.936 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 61.7 tp -62.96 -42.36 99.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.198 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -61.82 -48.82 78.88 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.508 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.29 -42.77 96.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.012 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.91 83.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.153 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -62.85 -48.43 79.06 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.408 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -59.91 -46.12 90.36 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 110.473 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . 0.633 ' HZ1' ' NH2' ' A' ' 282' ' ' ARG . 88.4 tttt -61.36 -40.65 95.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.364 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 33.8 tp -59.73 -43.35 94.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.086 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -59.82 -44.14 94.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.12 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -68.15 -40.7 82.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.727 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -62.11 -37.04 83.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.728 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . 0.401 ' OE2' ' CG1' ' A' ' 283' ' ' VAL . 62.1 mm-40 -55.11 -19.56 7.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.871 0.367 . . . . 0.0 110.619 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 71.1 m -76.58 -11.46 59.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.505 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 7.9 p -63.06 -46.91 94.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.686 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.505 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 79.95 -13.3 25.86 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . 0.457 ' H ' HG13 ' A' ' 277' ' ' VAL . 81.3 m-20 -76.65 -11.6 59.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.782 0.325 . . . . 0.0 110.608 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 65.01 -140.35 41.83 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 60.72 -71.87 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.893 0.378 . . . . 0.0 110.598 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . 0.633 ' NH2' ' HZ1' ' A' ' 270' ' ' LYS . 55.2 ttt85 -60.94 -33.51 73.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.416 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . 0.401 ' CG1' ' OE2' ' A' ' 275' ' ' GLU . 42.7 t -59.78 -45.65 94.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.548 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 45.6 t -61.16 -47.42 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.979 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.05 -47.3 80.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.922 0.391 . . . . 0.0 111.037 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 44.4 m -59.93 -43.31 95.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.685 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -63.91 -40.63 96.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -58.79 -59.11 5.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.322 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -63.96 -40.93 97.54 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.956 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -44.65 -53.96 6.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.16 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.4 -35.43 79.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.438 179.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 20.8 tp -60.39 -50.22 74.47 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.322 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.36 -42.08 98.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.303 0.573 . . . . 0.0 109.936 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.515 ' O ' ' OG1' ' A' ' 297' ' ' THR . 16.2 tm-20 -62.0 -39.71 93.16 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.955 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.91 -40.91 99.86 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 7.9 tpp180 -61.73 -43.73 98.28 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.323 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.525 ' CG2' HE21 ' A' ' 261' ' ' GLN . 44.0 p -60.42 -43.85 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.263 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -62.78 -43.92 97.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.461 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -61.5 -42.02 98.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.283 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -44.59 96.46 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.412 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.26 -44.89 93.21 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -62.15 -41.98 98.81 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.115 0.483 . . . . 0.0 110.462 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 303' ' ' THR . . . . . 0.443 HG22 ' CE1' ' A' ' 307' ' ' HIS . 19.3 m -60.52 -44.5 95.97 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.424 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -61.26 -42.35 93.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.896 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -56.98 -48.33 78.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.075 0.465 . . . . 0.0 110.313 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.34 -41.55 98.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.694 179.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.443 ' CE1' HG22 ' A' ' 303' ' ' THR . 37.4 m80 -65.01 -36.47 84.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.239 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 6.0 mt -62.38 -44.84 95.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.835 0.35 . . . . 0.0 110.34 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -69.86 -42.87 72.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.472 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -64.19 -45.23 89.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.791 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 23.1 mt -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.741 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 95.4 p -61.94 -38.49 88.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.357 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.57 -42.9 95.36 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -66.1 -67.32 0.45 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.761 0.315 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . 0.585 ' O ' ' N ' ' A' ' 317' ' ' ARG . 4.8 mt -53.02 -94.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.549 ' C ' ' O ' ' A' ' 315' ' ' ILE . 6.6 t 25.08 -88.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.914 0.388 . . . . 0.0 110.575 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 315' ' ' ILE . 55.4 ttp180 . . . . . 0 C--N 1.33 -0.256 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.864 0.364 . . . . 0.0 110.726 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.449 HH12 HD23 ' A' ' 57' ' ' LEU . 90.0 mtm180 -93.75 6.01 49.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.364 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.519 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 10.0 tpt -144.88 130.07 18.58 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -60.95 -38.29 85.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.357 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.8 -47.97 81.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.569 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.5 -38.63 88.05 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.727 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.519 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.4 m-80 -64.18 -40.13 95.46 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.488 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -60.77 -49.58 76.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.74 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.469 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 3.6 mm? -61.92 -40.88 97.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.215 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 47.7 t-105 -61.84 -46.26 90.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.134 0.492 . . . . 0.0 110.423 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.423 ' HA ' HE21 ' A' ' 33' ' ' GLN . 95.4 mt-10 -57.59 -42.85 83.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.462 179.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -61.6 -42.78 99.36 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.99 -44.69 87.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.162 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.423 HE21 ' HA ' ' A' ' 30' ' ' GLU . 33.8 mt-30 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.172 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -60.2 -43.48 95.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.142 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.9 mt -65.01 -36.87 85.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.261 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.85 110.37 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.741 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.8 mt -127.33 155.81 75.87 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.806 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -40.94 154.42 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.535 2.157 . . . . 0.0 112.189 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.71 -47.14 26.88 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.548 2.165 . . . . 0.0 112.556 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.25 -45.08 97.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.412 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.2 mmt85 -63.86 -40.59 96.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.53 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 tp -62.54 -43.71 98.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.529 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.98 89.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.412 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -67.9 -48.56 65.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.452 HD11 ' N ' ' A' ' 45' ' ' LEU . 8.1 mp -62.98 -45.46 92.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.646 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -63.8 -44.11 94.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.851 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.618 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.18 -48.73 80.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.071 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -57.43 -46.89 83.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.926 0.393 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.13 -40.84 86.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.917 0.389 . . . . 0.0 110.046 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.22 -39.91 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.088 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.618 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.9 mm -62.3 -43.78 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.054 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -58.62 -45.32 89.45 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.542 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.34 -47.01 87.03 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.128 0.489 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -64.16 -39.56 94.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.684 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.426 ' C ' ' OD1' ' A' ' 55' ' ' ASP . 60.4 t0 -60.56 -43.46 97.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.597 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -61.72 -43.88 97.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.033 0.444 . . . . 0.0 110.135 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.449 HD23 HH12 ' A' ' 21' ' ' ARG . 52.1 tp -60.5 -41.74 94.91 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.199 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.3 99.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.605 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.8 -42.41 93.36 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.342 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -61.08 -45.45 94.67 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -57.84 -44.02 86.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.179 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.9 mt -61.92 -42.11 98.72 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.139 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -56.26 -47.05 79.3 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.27 -0.572 . . . . 0.0 109.639 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.946 178.991 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.79 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -64.31 -35.13 79.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.701 0.286 . . . . 0.0 110.275 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -58.04 -59.8 4.72 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.129 0.49 . . . . 0.0 110.162 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -55.57 -41.48 73.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.283 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.2 -38.67 87.37 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.352 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -62.49 -42.94 99.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.462 ' N ' HD12 ' A' ' 77' ' ' LEU . 10.2 mp -62.47 -43.08 99.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.49 -47.52 91.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.215 0.531 . . . . 0.0 110.134 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.3 mtt85 -61.21 -41.22 96.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.218 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.436 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.58 -49.26 78.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.082 0.468 . . . . 0.0 110.346 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.07 -38.54 88.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.14 -47.05 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.636 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.8 -49.35 84.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.436 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.035 0.445 . . . . 0.0 110.724 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.84 93.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.849 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -61.63 -48.38 81.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.435 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -76.25 -16.31 59.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.12 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 58.51 38.42 91.03 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.5 mt . . . . . 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 110.547 -179.99 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.0 mt . . . . . 0 N--CA 1.462 0.136 0 CA-C-O 120.863 0.363 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.627 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 39.6 mt-10 -58.44 -42.2 86.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.8 mttt -60.16 -42.55 95.16 Favored 'General case' 0 C--N 1.318 -0.761 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.435 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.4 mt -64.4 -47.44 79.18 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.068 0.461 . . . . 0.0 111.773 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.464 ' CE2' HD12 ' A' ' 135' ' ' LEU . 10.2 t-105 -64.24 -44.78 90.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.592 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.627 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -69.24 -34.98 75.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.745 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.554 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.4 mptt -60.25 -51.2 70.58 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.232 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -74.57 -46.31 39.63 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.722 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.41 ' HD2' ' NE1' ' A' ' 121' ' ' TRP . 62.9 tttp -53.21 -44.26 67.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.311 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -102.68 -60.08 1.6 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.935 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -61.65 -6.21 2.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.787 -178.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -135.65 4.41 4.0 Favored Glycine 0 C--N 1.329 0.174 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.486 ' CG ' ' O ' ' A' ' 128' ' ' GLY . 19.0 ptpt 43.44 21.09 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.17 0.509 . . . . 0.0 109.84 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.495 ' N ' ' O ' ' A' ' 128' ' ' GLY . 32.8 m-85 -78.78 50.75 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.586 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.7 p -94.5 130.11 41.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 112.105 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.13 -98.72 1.33 Allowed Glycine 0 CA--C 1.534 1.267 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.869 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.451 ' HG2' ' H ' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -80.3 -43.64 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.049 -179.226 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.451 ' H ' ' HG2' ' A' ' 133' ' ' GLU . 67.8 mm-40 -64.96 -42.96 94.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.464 HD12 ' CE2' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.79 -43.51 98.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.942 179.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -62.3 -39.29 92.51 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.952 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -60.41 -43.29 96.87 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.37 0.605 . . . . 0.0 109.852 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.415 ' N ' HD21 ' A' ' 138' ' ' LEU . 2.8 mm? -59.68 -43.84 93.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -36.92 85.65 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.55 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 88.7 mtt-85 -53.49 -41.51 66.33 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . 0.542 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 0.4 OUTLIER -71.26 -43.36 67.36 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.853 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -58.47 -54.86 42.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.407 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.49 -38.91 89.04 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.309 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 34.9 m170 -54.75 -42.79 72.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.613 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -66.31 -39.8 89.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.637 178.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -61.27 -47.25 86.87 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.379 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -71.49 -43.01 67.33 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.541 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.67 -44.13 97.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.797 0.332 . . . . 0.0 110.456 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.9 t -64.4 -44.43 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.603 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.629 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -60.63 -39.58 88.75 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.43 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.81 -43.18 99.48 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.678 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.557 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 24.5 m-85 -65.45 -49.63 68.43 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.842 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -68.62 -42.26 78.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.023 0.44 . . . . 0.0 110.997 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.629 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 73.2 t -63.03 -45.16 99.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.947 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.5 mt . . . . . 0 C--N 1.329 -0.316 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.761 179.904 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 . . . . . 0 C--O 1.231 0.103 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.487 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 8.5 mp -63.18 -41.06 99.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.459 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.546 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 67.5 mttm -67.35 -34.06 76.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.59 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.479 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 97.2 mt-10 -67.6 -50.28 58.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.557 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 10.6 ptmt -72.28 -44.7 62.39 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.358 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.548 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.95 -41.51 86.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.102 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.546 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -65.92 -36.88 84.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 192' ' ' GLU . 55.6 m -61.56 -43.38 98.97 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.42 -44.12 97.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.849 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.439 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.3 m-20 -62.0 -42.05 98.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.582 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.477 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 14.9 mm100 -62.24 -38.59 89.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.381 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.4 -42.3 99.74 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 18.3 mt -63.25 -41.97 99.12 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.235 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.498 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.1 OUTLIER -62.8 -36.64 83.8 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -63.92 -42.27 97.43 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.616 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.48 -39.43 90.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.409 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -62.04 -45.12 94.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.222 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.554 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.7 mtt180 -65.3 -36.58 84.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.16 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.51 -45.88 96.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.252 0.548 . . . . 0.0 110.279 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 80.6 p -72.37 -26.67 61.98 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.535 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -95.34 -14.58 23.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.513 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -146.11 -25.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.718 0.294 . . . . 0.0 111.109 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.518 0.271 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 220' ' ' GLU . 2.2 tm-20 . . . . . 0 N--CA 1.445 -0.695 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 59.3 mt-10 -87.26 148.97 46.05 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.163 176.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.75 81.93 1.27 Allowed 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.564 2.176 . . . . 0.0 112.146 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 175.98 -36.6 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.752 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.583 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 1.5 p -68.92 -76.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.168 0.508 . . . . 0.0 110.698 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.583 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 1.2 mp -50.61 -26.65 4.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.132 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -67.01 -50.03 63.43 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.371 0.605 . . . . 0.0 109.943 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 12.3 tp -56.79 -37.41 71.1 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 44.8 m0 -63.96 -42.56 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.193 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . 0.507 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 97.1 m-20 -66.76 -18.44 65.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.466 ' O ' ' N ' ' A' ' 232' ' ' SER . 1.7 mt -77.81 -44.61 26.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.061 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 232' ' ' SER . . . -36.68 -62.16 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.198 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.507 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 7.4 pt20 -38.39 -31.94 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.673 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.466 ' N ' ' O ' ' A' ' 229' ' ' LEU . 66.5 m -118.4 52.62 1.01 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.374 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -141.41 46.26 1.71 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . 0.542 ' N ' ' ND2' ' A' ' 234' ' ' ASN . 0.8 OUTLIER 61.95 72.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.379 179.574 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 20.0 mt -125.08 148.04 48.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.696 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 66.6 p -66.36 -165.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.463 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . 0.507 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 31.3 p-10 -95.84 -48.18 5.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . 0.507 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 97.9 mttt -62.58 -43.35 99.03 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.03 0.443 . . . . 0.0 110.675 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -64.68 -33.63 76.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.013 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . 0.402 ' O ' HD12 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -62.56 -43.49 98.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.306 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -65.12 -49.66 69.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.405 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.14 -39.91 91.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.089 0.471 . . . . 0.0 110.002 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.486 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.14 -44.11 93.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.103 179.033 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -47.55 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.036 0.445 . . . . 0.0 110.193 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -65.62 -47.43 75.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.751 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -56.28 -50.94 69.93 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.495 0.664 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.6 mm? -63.43 -37.82 88.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.776 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.452 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 89.0 tttt -53.76 -45.38 70.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.391 0.615 . . . . 0.0 109.995 -179.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -67.48 -40.63 85.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.697 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -61.01 -48.98 79.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.638 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.452 ' CG ' ' O ' ' A' ' 248' ' ' LYS . 13.5 pt-20 -59.31 -38.16 79.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . 0.409 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -65.48 -38.17 88.98 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.521 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -62.9 -49.57 74.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.554 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 9.7 tt -64.97 -31.84 55.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.17 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -62.22 -46.36 89.22 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.214 0.53 . . . . 0.0 110.054 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.22 -42.48 99.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.973 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -56.42 -43.83 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.339 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -61.93 -40.79 96.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.118 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -57.03 -46.33 82.45 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.274 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -63.7 -37.4 87.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.513 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 30.8 mm-40 -57.72 -48.72 78.79 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.35 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -62.28 -43.1 99.61 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.189 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -65.49 -35.42 80.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.973 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 39.4 tp -63.7 -43.85 95.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.42 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -64.21 -44.72 91.06 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.542 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.44 -42.93 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.089 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.61 87.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.361 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -62.02 -48.52 79.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -61.61 -46.69 88.78 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 110.66 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.78 -37.66 85.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.349 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 49.3 tp -61.82 -43.99 97.74 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -61.59 -43.0 99.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.41 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -72.13 -37.69 69.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . 0.453 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -63.1 -37.12 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.862 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.7 -30.77 71.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.715 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 90.7 p -86.71 2.43 48.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.712 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.456 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 9.5 p -60.74 -41.97 90.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.455 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.456 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 123.73 -57.45 0.65 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -96.74 111.35 23.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.803 0.335 . . . . 0.0 110.584 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -74.08 106.93 2.13 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -136.6 -21.08 1.32 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.311 . . . . 0.0 110.651 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -124.81 -4.22 7.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.705 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 284' ' ' SER . 11.3 p -63.24 -46.04 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 284' ' ' SER . . . . . 0.412 ' N ' ' CG1' ' A' ' 283' ' ' VAL . 10.6 t -63.78 -49.34 73.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.075 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.53 -43.03 98.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.86 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 48.5 t -60.27 -44.56 95.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.52 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . 0.421 ' O ' ' HB3' ' A' ' 290' ' ' HIS . 60.0 ttt85 -63.24 -41.05 99.04 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.228 0.537 . . . . 0.0 110.632 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -56.81 -57.51 12.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.252 0.548 . . . . 0.0 109.959 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -64.54 -31.34 72.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.153 179.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . 0.421 ' HB3' ' O ' ' A' ' 287' ' ' ARG . 52.0 t-80 -53.13 -49.93 65.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.29 -37.62 71.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.618 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 26.3 tp -61.46 -50.76 71.46 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.594 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.3 mp -63.82 -41.65 97.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.135 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.16 -40.46 97.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.323 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.69 -47.21 91.8 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -63.66 -37.45 87.39 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.51 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.513 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 8.3 m -60.23 -50.27 74.31 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.488 -179.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.41 -40.07 96.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.412 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -58.93 -45.47 90.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.358 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.46 -44.51 96.98 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.297 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.36 -43.56 84.74 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . 0.475 ' CE1' ' NZ ' ' A' ' 306' ' ' LYS . 49.3 t80 -62.25 -42.43 99.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.162 0.506 . . . . 0.0 110.489 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 17.2 m -60.48 -44.29 96.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.643 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.31 -43.25 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.046 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.79 -49.44 76.61 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.045 0.45 . . . . 0.0 110.937 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . 0.475 ' NZ ' ' CE1' ' A' ' 302' ' ' TYR . 34.7 mmtm -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.805 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -66.31 -31.25 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.921 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.12 -49.92 75.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.238 -179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -69.71 -40.1 76.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.634 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -60.05 -51.17 70.76 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.885 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 30.2 mt -63.25 -39.82 95.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.442 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.7 t -58.89 -43.41 90.94 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.685 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.9 -49.89 56.1 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . 0.726 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.93 -43.6 95.4 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.7 mm -64.34 -43.14 97.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.809 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 99.5 p -56.07 -34.55 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.864 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 14.3 tpp180 . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.493 -179.352 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 . . . . . 0 N--CA 1.462 0.171 0 CA-C-O 121.022 0.439 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp85 -77.4 -11.48 59.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.69 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -134.83 145.7 48.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 110.988 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.35 -33.65 76.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.722 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -59.02 -47.23 85.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 109.887 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.421 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 9.4 mp -64.13 -37.94 89.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.292 178.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -63.79 -41.24 97.96 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.602 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -65.15 -45.12 86.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.107 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.47 HD23 ' N ' ' A' ' 28' ' ' LEU . 1.6 mm? -63.36 -41.78 98.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.479 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -63.29 -47.81 80.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.09 0.472 . . . . 0.0 110.358 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.5 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 80.8 tt0 -60.83 -39.19 88.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.199 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -45.0 96.38 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.06 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -41.36 96.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -59.45 -40.05 85.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.027 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.5 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -64.57 -39.01 92.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.339 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.4 mt -63.54 -36.73 84.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.383 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 65.95 106.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.604 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -129.4 154.47 80.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.63 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -43.95 153.77 0.28 Allowed 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.369 2.046 . . . . 0.0 112.528 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -58.73 -41.05 67.31 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.681 2.254 . . . . 0.0 112.364 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.01 -49.12 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.852 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.74 -41.57 92.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.622 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -65.25 -42.36 93.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -51.71 64.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.176 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.01 -38.48 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.504 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.9 tp -62.16 -50.77 70.51 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.043 0.449 . . . . 0.0 110.621 -179.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -61.1 -40.82 95.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.21 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.601 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.29 -49.77 75.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.073 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -58.82 -46.03 88.58 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.996 0.427 . . . . 0.0 110.584 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.0 mt -59.93 -41.07 90.95 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -58.99 -38.79 80.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.145 178.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.601 HG12 ' O ' ' A' ' 47' ' ' ALA . 45.5 mm -62.16 -44.42 99.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -58.81 -43.96 90.69 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.606 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.97 -48.37 81.79 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.971 0.415 . . . . 0.0 110.453 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -60.25 -44.54 95.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.752 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.94 -40.66 94.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.505 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.07 -45.74 91.9 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 110.103 179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.31 -42.97 99.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.966 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.83 96.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.557 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.2 t90 -58.52 -44.08 89.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.095 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.77 -46.5 90.21 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 120.624 -0.43 . . . . 0.0 109.914 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.11 -41.05 97.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.085 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.677 ' CD1' ' HZ3' ' A' ' 73' ' ' LYS . 79.7 mt -61.62 -41.2 97.14 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.45 -38.74 88.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.981 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.57 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.02 -40.69 91.29 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.573 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.677 ' HZ3' ' CD1' ' A' ' 62' ' ' LEU . 39.7 mtpt -62.49 -47.81 82.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.021 0.439 . . . . 0.0 110.362 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.99 -42.55 94.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.467 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.84 -40.28 94.77 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -62.25 -41.97 98.92 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.608 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.52 -43.8 96.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.444 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.405 HD11 HG21 ' A' ' 78' ' ' ILE . 96.7 mt -64.77 -45.66 94.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.302 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.423 ' O ' ' CG2' ' A' ' 83' ' ' VAL . 92.1 mtt-85 -63.09 -41.29 99.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.992 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -64.03 -39.59 94.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.337 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.407 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -60.16 -51.39 69.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.901 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.436 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 60.7 t-20 -66.23 -38.91 89.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.705 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.423 ' CG2' ' O ' ' A' ' 79' ' ' ARG . 60.8 t -62.29 -47.46 92.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.691 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.423 HD11 HG23 ' A' ' 84' ' ' ILE . 96.6 mt -62.9 -47.11 94.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.63 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.23 -41.11 90.51 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.638 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.59 -47.62 84.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.989 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -62.64 -44.8 95.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 110.404 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -63.65 -32.74 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.065 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 79.46 22.61 64.43 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.332 -0.157 0 CA-C-O 120.886 0.374 . . . . 0.0 110.338 -179.88 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.863 0.364 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 93.5 mt-10 -59.5 -44.02 93.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 20.3 pttp -60.6 -41.5 94.89 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.257 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.429 ' N ' ' CG ' ' A' ' 119' ' ' LYS . 11.8 mt -62.12 -44.92 95.59 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.638 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.424 ' CE2' HD12 ' A' ' 135' ' ' LEU . 15.6 t-105 -61.76 -47.16 86.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.318 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.508 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.9 m-70 -67.68 -38.9 84.34 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.125 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.545 ' O ' ' CB ' ' A' ' 127' ' ' SER . 12.9 tptt -58.58 -51.45 69.83 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.911 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.04 -45.75 63.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.649 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -48.33 -44.45 34.19 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.196 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.453 ' C ' ' H ' ' A' ' 128' ' ' GLY . 23.3 m -107.08 -60.54 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.818 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.71 -8.87 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.898 -178.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 0.587 ' C ' ' H ' ' A' ' 130' ' ' PHE . . . -137.58 4.38 3.34 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 48.92 11.03 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.135 0.493 . . . . 0.0 109.786 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.587 ' H ' ' C ' ' A' ' 128' ' ' GLY . 24.3 m-85 -71.58 50.45 0.18 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.421 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.7 p -97.94 112.9 24.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 112.145 -179.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.404 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.44 -98.37 0.62 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.711 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.465 ' CG ' ' N ' ' A' ' 134' ' ' GLU . 10.0 pt-20 -77.18 -44.0 31.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.839 0.352 . . . . 0.0 111.31 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.465 ' N ' ' CG ' ' A' ' 133' ' ' GLU . 79.5 mm-40 -66.08 -41.92 90.05 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.424 HD12 ' CE2' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.07 -43.18 99.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.862 179.373 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.513 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.3 OUTLIER -62.31 -37.99 87.68 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.936 179.769 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.434 ' N ' ' OD1' ' A' ' 136' ' ' ASP . 36.2 mmtm -60.15 -44.15 95.2 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.981 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.454 HD22 ' O ' ' A' ' 134' ' ' GLU . 3.6 mm? -60.64 -43.03 98.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.34 -34.84 79.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 177.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -58.5 -39.09 79.09 Favored 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.988 178.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -70.62 -44.29 67.51 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.995 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -58.91 -56.29 24.18 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.74 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.768 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 97.4 mt -60.82 -39.84 90.53 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.579 -0.448 . . . . 0.0 109.815 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -55.19 -41.28 71.75 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.479 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -63.87 -45.88 87.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.384 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.768 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 46.7 pttt -57.55 -45.75 84.74 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.549 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.533 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 77.8 mm-40 -68.91 -50.18 51.7 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -63.09 -44.32 96.04 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.975 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . 0.404 HG12 ' O ' ' A' ' 146' ' ' LYS . 1.2 p -64.88 -38.09 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.716 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.572 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.3 m170 -65.92 -41.26 91.63 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.228 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.38 -43.16 95.37 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.939 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.514 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 3.8 m-85 -61.88 -50.84 70.62 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.853 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -69.77 -44.05 70.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.307 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.572 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 74.2 t -63.4 -46.9 94.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.922 -179.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 74.0 mt . . . . . 0 C--O 1.239 0.509 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.401 -179.807 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 . . . . . 0 CA--C 1.52 -0.178 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.493 ' CD2' ' HZ3' ' A' ' 193' ' ' LYS . 14.2 mt -61.73 -45.55 93.43 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.083 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 55.9 pttt -80.45 -34.28 36.12 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.582 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 42.7 tt0 -69.24 -42.89 75.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.026 -179.33 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.514 ' HD2' ' CE1' ' A' ' 152' ' ' TYR . 10.1 pttm -74.34 -43.2 57.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.524 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -68.6 -40.01 80.65 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.873 -179.726 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.476 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.2 ptm180 -67.6 -39.62 84.78 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 196' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 75.5 p -60.49 -40.79 92.58 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 193' ' ' LYS . 85.6 mt -64.93 -43.42 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.894 178.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -62.58 -42.46 99.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.776 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -65.75 -32.29 73.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.081 178.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.02 -46.18 94.03 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 28.9 mt -63.42 -42.02 98.72 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.028 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.59 -36.58 84.27 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -42.02 98.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.379 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 78.7 mt -61.62 -41.55 97.63 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -64.25 -42.48 96.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.024 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.696 ' O ' ' N ' ' A' ' 210' ' ' GLN . 15.4 mmm180 -65.32 -40.9 94.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.981 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.66 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.2 t -63.77 -45.38 97.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.043 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.9 p -67.85 -28.19 67.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.762 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -101.66 -14.67 17.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.61 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.696 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.6 tt0 -131.59 -28.2 1.86 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.86 0.362 . . . . 0.0 111.107 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.66 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.52 0.382 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.401 ' O ' ' CD ' ' A' ' 219' ' ' GLU . 8.4 tm-20 . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -60.74 155.59 50.65 Favored Pre-proline 0 N--CA 1.464 0.235 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.203 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.12 119.32 6.51 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 C-N-CA 122.149 1.9 . . . . 0.0 112.051 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 178.63 -93.58 0.0 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.757 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -47.16 93.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.733 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 1.1 mp -65.41 -26.71 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.836 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -67.45 -46.54 72.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 109.767 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 5.0 tp -61.14 -41.27 96.43 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.354 179.302 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 44.2 m0 -60.06 -42.01 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.066 -0.653 . . . . 0.0 109.677 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -65.06 -29.84 70.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 4.0 mt -62.2 -43.26 99.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.872 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.468 ' O ' ' CD2' ' A' ' 235' ' ' LEU . . . -36.07 -42.91 0.31 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.919 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -39.53 -34.24 0.21 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.855 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 39.3 m -130.87 66.14 1.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.532 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . 0.473 ' H ' ' CD1' ' A' ' 235' ' ' LEU . . . -144.2 46.7 1.42 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . 0.411 ' N ' HD11 ' A' ' 235' ' ' LEU . 58.9 t30 63.17 73.56 0.45 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.494 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . 0.58 ' N ' ' CD1' ' A' ' 235' ' ' LEU . 0.3 OUTLIER -108.85 -160.32 0.72 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.095 0.474 . . . . 0.0 110.843 179.719 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 236' ' ' THR . . . . . 0.4 ' OG1' ' CD ' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -131.74 -146.97 0.3 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.746 -179.157 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -101.59 -66.17 0.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.814 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.35 -40.9 97.92 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.446 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . 0.4 ' CD ' ' OG1' ' A' ' 236' ' ' THR . 34.0 mt-10 -61.93 -35.38 78.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.884 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.15 -46.04 89.05 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.79 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -65.34 -44.81 86.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.473 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.27 -41.45 93.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.49 -44.67 93.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.724 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -58.76 -52.98 63.39 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 -178.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -64.96 -36.91 85.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.697 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -61.79 -45.0 95.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.359 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.488 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 1.9 mm? -63.34 -41.23 98.86 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.768 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.74 -39.81 90.08 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.888 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -63.96 -63.04 1.26 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 29.4 t80 -59.78 -45.23 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 0.0 110.924 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.488 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 53.1 tp10 -55.03 -41.58 71.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.15 80.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -59.92 -45.83 91.34 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.838 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . 0.468 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.4 tp -66.84 -42.42 89.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.919 179.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.34 -45.59 92.91 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.713 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.73 -41.58 99.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.29 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -43.45 81.04 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -61.58 -40.79 96.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.212 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . 0.513 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 79.7 t60 -58.96 -47.95 83.29 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.212 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -62.29 -37.04 83.97 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.344 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -43.79 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -61.82 -46.92 87.38 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.805 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . 0.513 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.0 mp0 -63.39 -36.77 84.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.864 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 50.3 tp -61.66 -42.46 98.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.348 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -63.05 -46.8 85.8 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.74 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.6 mt -63.02 -42.98 98.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.965 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.81 83.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.084 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -62.18 -44.88 95.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.35 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -59.24 -46.84 87.42 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.048 0.451 . . . . 0.0 110.344 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -60.48 -40.38 91.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.345 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . 0.4 ' CD2' ' OE2' ' A' ' 275' ' ' GLU . 5.4 tt -59.52 -44.11 93.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -59.37 -44.48 92.73 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.995 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -67.63 -42.62 82.04 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.668 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . 0.465 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -60.7 -35.35 76.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.926 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . 0.4 ' OE2' ' CD2' ' A' ' 271' ' ' LEU . 90.7 mt-10 -61.31 -28.83 69.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.843 0.354 . . . . 0.0 110.447 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 97.1 p -89.1 5.91 42.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . 0.465 ' CG1' ' O ' ' A' ' 274' ' ' ALA . 11.8 p -60.88 -44.2 97.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.702 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . 0.442 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 134.76 -86.67 0.25 Allowed Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -62.93 -39.96 96.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.721 0.296 . . . . 0.0 110.603 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . 0.54 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 87.91 -106.52 3.22 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 63.16 -53.8 0.19 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.851 0.358 . . . . 0.0 110.568 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . 0.54 ' N ' ' O ' ' A' ' 280' ' ' GLY . 16.4 ptm180 -72.26 -15.42 61.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.509 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.8 t -60.61 -44.95 97.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.43 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.1 t -59.97 -44.9 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.006 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -61.59 -43.21 99.29 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.025 0.44 . . . . 0.0 110.532 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 5.6 t -60.94 -42.35 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.093 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -61.67 -41.72 97.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.279 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -57.62 -53.74 54.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.262 -0.427 . . . . 0.0 109.895 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -64.62 -34.36 78.09 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.211 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -58.21 -46.41 85.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.058 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.78 -40.36 79.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.913 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . 0.4 ' CD1' ' C ' ' A' ' 292' ' ' LEU . 1.3 tp -62.92 -52.86 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.87 -43.28 99.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.149 0.5 . . . . 0.0 110.232 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.01 -36.54 84.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.88 -50.44 65.76 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 110.539 -1.025 . . . . 0.0 110.539 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -59.69 -41.28 90.36 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 5.9 m -59.45 -49.15 78.92 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 120.962 0.41 . . . . 0.0 110.04 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -63.72 -44.29 94.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -57.74 -40.22 79.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.03 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.24 -43.14 99.49 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.855 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.95 -43.4 94.93 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -61.88 -44.45 96.79 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.095 0.474 . . . . 0.0 110.778 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.5 m -60.07 -43.7 95.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.206 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.4 -44.24 92.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.924 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.78 -54.66 43.81 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.076 -179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -62.98 -41.69 99.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.46 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -61.68 -39.15 90.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.047 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . 0.438 ' O ' ' OG ' ' A' ' 312' ' ' SER . 26.0 mt -60.66 -44.55 96.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.439 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . 0.598 ' N ' ' OE1' ' A' ' 309' ' ' GLN . 0.0 OUTLIER -63.12 -49.31 74.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.592 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -63.03 -68.88 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.158 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 1.8 tp -41.68 -46.4 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.704 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 312' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 56.6 m -60.02 -41.8 92.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.514 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.59 -35.96 92.57 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 315' ' ' ILE . 18.1 mmm180 -73.54 -64.69 0.94 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.829 0.314 . . . . 0.0 110.977 -179.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . 0.71 HG22 ' N ' ' A' ' 316' ' ' SER . 0.8 OUTLIER -40.59 -104.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.228 -179.071 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 316' ' ' SER . . . . . 0.71 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.0 OUTLIER 62.37 -5.27 0.18 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . 0.621 ' H ' ' C ' ' A' ' 315' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.372 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 . . . . . 0 C--O 1.234 0.267 0 CA-C-O 120.658 0.266 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -64.48 -36.8 85.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.82 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.6 mmm -118.56 148.75 42.33 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.21 0.529 . . . . 0.0 110.788 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.67 -38.12 88.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.694 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.29 -47.59 83.16 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.185 0.517 . . . . 0.0 110.321 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.9 tp -63.14 -38.59 91.78 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.501 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -64.24 -40.02 95.15 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.379 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.7 tp60 -62.81 -42.21 99.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.163 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.412 ' C ' ' CD1' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -62.08 -44.4 96.74 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.016 0.436 . . . . 0.0 109.95 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -60.51 -49.57 77.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.362 0.601 . . . . 0.0 110.385 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -58.22 -38.54 77.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.279 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 tppt? -60.61 -46.06 91.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.179 0.514 . . . . 0.0 110.235 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.46 91.91 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.006 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.586 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 89.2 mt-30 -58.58 -38.64 78.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.194 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.589 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 62.8 ttm-85 -62.47 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.45 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.512 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.589 ' CE1' ' O ' ' A' ' 34' ' ' ARG . 25.9 m80 66.0 113.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.7 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 mt -137.45 154.99 75.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.858 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -43.31 155.1 0.16 Allowed 'Trans proline' 0 C--N 1.311 -1.434 0 C-N-CA 122.657 2.238 . . . . 0.0 112.12 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -65.43 -34.78 42.21 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.648 2.232 . . . . 0.0 112.094 -179.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG21 ' H ' ' A' ' 41' ' ' ARG . 3.0 m -68.02 -47.94 76.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.673 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.498 ' H ' HG21 ' A' ' 40' ' ' VAL . 96.9 mtt180 -66.87 -40.06 87.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.416 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.28 -44.09 97.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.501 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.58 -45.53 90.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.431 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.7 tp10 -66.72 -42.76 85.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.502 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.88 -49.55 74.38 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.728 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -58.94 -40.54 84.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.053 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.646 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.36 -48.82 80.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.682 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.11 -49.31 72.06 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.539 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.6 mt -58.59 -40.62 83.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.145 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.27 -37.37 80.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.981 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.9 mm -63.23 -43.44 98.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.792 179.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.4 ' NE2' ' ND2' ' A' ' 80' ' ' ASN . 99.0 mm-40 -57.14 -45.76 83.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.165 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.94 -49.9 76.08 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.263 0.554 . . . . 0.0 110.133 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -59.53 -44.77 93.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.457 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -61.41 -37.54 83.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -58.45 -47.93 82.38 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.007 0.432 . . . . 0.0 109.864 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.0 mt -60.75 -42.01 96.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.211 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.25 -48.2 82.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.428 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -56.8 -39.28 73.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.253 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm -59.86 -46.64 88.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -60.6 -45.51 93.71 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.471 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.15 -39.55 92.99 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.99 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -58.66 -42.97 89.66 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.433 ' C ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.832 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.56 -38.94 86.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.755 0.312 . . . . 0.0 110.332 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.544 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 55.4 mttp -56.78 -57.57 11.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.004 0.43 . . . . 0.0 110.154 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -53.2 -39.14 63.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.183 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.85 -40.25 92.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.272 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.544 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 88.0 mtm180 -63.35 -39.26 94.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.58 -44.5 93.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -47.24 89.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.381 0.61 . . . . 0.0 110.224 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -61.44 -41.93 97.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.119 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.498 ' O ' HG13 ' A' ' 84' ' ' ILE . 38.6 t30 -61.25 -41.03 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.257 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.429 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.75 -48.69 80.68 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.191 0.52 . . . . 0.0 110.06 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.75 -39.13 87.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.578 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.2 t -63.52 -45.98 96.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.411 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -60.43 -49.01 86.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.354 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.73 -42.82 85.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.965 0.412 . . . . 0.0 111.069 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.62 -45.82 92.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.549 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.66 -47.46 83.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.602 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.83 -22.35 66.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.128 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 77.15 19.81 76.48 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 43.8 mt . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.816 0.341 . . . . 0.0 110.422 179.774 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.2 mt . . . . . 0 C--O 1.234 0.266 0 CA-C-O 121.005 0.431 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 93.8 mt-10 -61.05 -34.65 75.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.619 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 71.3 mmtt -59.91 -44.07 94.48 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.468 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.12 -44.44 72.39 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.885 0.374 . . . . 0.0 111.69 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.428 ' HE1' ' HD2' ' A' ' 125' ' ' LYS . 16.4 t-105 -61.57 -46.69 88.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.847 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.573 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.5 m-70 -68.57 -37.61 80.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.768 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.7 OUTLIER -57.31 -51.92 67.42 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.898 -178.543 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.32 -45.99 52.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.999 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.428 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 62.1 tttm -48.54 -44.19 36.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.84 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.403 ' C ' ' H ' ' A' ' 128' ' ' GLY . 21.8 m -108.62 -63.46 1.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.907 -179.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -54.89 -11.73 0.68 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.598 -178.725 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 0.56 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -131.76 -3.09 4.19 Favored Glycine 0 CA--C 1.519 0.301 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' SER . 46.5 mttp 54.69 8.71 0.23 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.223 0.535 . . . . 0.0 109.848 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . 0.56 ' CD1' ' O ' ' A' ' 128' ' ' GLY . 14.2 m-30 -67.82 51.19 0.06 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.821 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.431 ' N ' ' O ' ' A' ' 129' ' ' LYS . 96.8 p -97.63 112.29 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.762 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 122.94 -97.93 0.59 Allowed Glycine 0 CA--C 1.528 0.871 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.299 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.418 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.7 mm-40 -77.74 -44.01 29.11 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.042 -179.135 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.4 mp0 -65.6 -43.87 88.35 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.529 -0.469 . . . . 0.0 109.9 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 130' ' ' PHE . 0.6 OUTLIER -62.04 -41.4 98.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.886 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -63.67 -36.93 85.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.945 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.2 mttt -63.0 -44.1 96.95 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.418 0.628 . . . . 0.0 110.057 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.02 -42.55 94.59 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -66.07 -37.83 86.79 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.619 -0.718 . . . . 0.0 112.687 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.547 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 0.6 OUTLIER -51.85 -41.64 62.0 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 0.7 OUTLIER -70.22 -42.42 72.32 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.539 178.672 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.41 -52.85 63.86 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.209 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.539 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.5 mm? -61.96 -40.64 96.26 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.307 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.547 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 45.2 m170 -53.55 -44.99 69.69 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.474 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.475 ' O ' ' HB ' ' A' ' 149' ' ' VAL . 3.4 m-70 -63.83 -41.63 97.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.572 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 149' ' ' VAL . 16.6 mmmt -60.27 -41.47 93.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.159 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . 0.532 ' HA ' ' HD1' ' A' ' 150' ' ' HIS . 50.5 mt-10 -70.2 -55.49 9.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.558 -179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -63.52 -44.21 94.93 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.406 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . 0.523 ' CG1' ' N ' ' A' ' 150' ' ' HIS . 2.8 p -60.83 -44.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.438 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' HIS . . . . . 0.696 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 1.2 p-80 -66.15 -33.71 76.4 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.324 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . 0.609 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 91.7 mt-10 -63.33 -39.94 95.94 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.313 -0.555 . . . . 0.0 109.892 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -61.93 -49.4 76.32 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.084 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -68.64 -43.78 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.401 HG21 ' O ' ' A' ' 150' ' ' HIS . 19.3 t -60.75 -45.07 98.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.096 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.4 mt . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.539 -179.477 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 . . . . . 0 CA--C 1.52 -0.185 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 0.8 OUTLIER -60.98 -45.25 95.55 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.718 179.367 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 191' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 63.3 mttp -70.15 -36.1 74.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -68.06 -47.9 67.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.059 0.457 . . . . 0.0 111.741 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.443 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 15.8 pttt -73.13 -41.61 63.78 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.416 -179.219 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.535 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.67 -41.11 79.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.063 -179.59 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 195' ' ' ARG . . . . . 0.521 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 36.1 ptt180 -67.57 -39.12 84.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 67.4 m -58.64 -42.38 88.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 91.2 mt -64.14 -43.64 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.429 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -61.1 -40.92 95.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.415 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 199' ' ' GLN . . . . . 0.504 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 94.7 mt-30 -60.51 -40.31 90.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.52 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.6 -41.48 99.58 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 201' ' ' LEU . 1.4 mm? -63.24 -41.17 99.04 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.155 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 202' ' ' ASP . . . . . 0.551 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.2 OUTLIER -62.61 -37.39 86.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.41 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 203' ' ' ARG . . . . . 0.459 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 8.0 tmm_? -61.46 -43.85 98.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.731 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.1 mt -61.67 -40.26 94.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -64.85 -42.04 95.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.126 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.744 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -61.43 -45.33 94.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.366 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 207' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.296 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 89.3 p -61.89 -37.33 84.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.543 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -94.33 -43.09 8.57 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.102 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 210' ' ' GLN . . . . . 0.744 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.6 tt0 -87.05 -42.92 12.7 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 211' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.43 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 220' ' ' GLU . 11.3 tm-20 . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 121.115 0.483 . . . . 0.0 110.292 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 220' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 0.0 OUTLIER 54.78 169.91 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.988 -179.878 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 221' ' ' PRO . . . . . 0.557 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 41.4 Cg_exo -55.85 150.86 43.57 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.461 2.107 . . . . 0.0 112.025 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 222' ' ' ARG . . . . . 0.715 ' O ' ' N ' ' A' ' 225' ' ' ASP . 24.1 ttp180 87.51 -139.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.493 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 223' ' ' VAL . . . . . 0.502 ' C ' ' O ' ' A' ' 222' ' ' ARG . 2.5 m 27.77 -104.17 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.207 0.527 . . . . 0.0 110.72 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . 0.456 ' H ' ' CG2' ' A' ' 223' ' ' VAL . 1.3 mp -59.78 -39.05 78.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.787 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 225' ' ' ASP . . . . . 0.715 ' N ' ' O ' ' A' ' 222' ' ' ARG . 55.9 m-20 -62.53 -40.66 97.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.8 tp -60.0 -43.56 95.11 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.338 0.59 . . . . 0.0 109.491 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 227' ' ' TRP . . . . . 0.407 ' CD1' ' N ' ' A' ' 227' ' ' TRP . 26.0 m0 -63.14 -33.95 76.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.695 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -61.42 -38.95 88.98 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 229' ' ' LEU . . . . . 0.513 ' O ' ' N ' ' A' ' 232' ' ' SER . 97.8 mt -63.44 -42.1 98.66 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.787 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 230' ' ' ALA . . . . . 0.498 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -28.3 -44.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.955 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 231' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 229' ' ' LEU . 8.7 tt0 -67.33 -53.56 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.719 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 232' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 229' ' ' LEU . 30.2 t -68.61 -18.1 64.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.5 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -69.02 -82.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.657 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -177.6 98.81 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.631 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 53.4 mt -145.09 151.62 38.79 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.1 p -79.62 169.25 18.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.691 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -61.38 -48.24 82.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.829 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -60.28 -49.29 78.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.99 0.424 . . . . 0.0 110.817 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.24 -37.52 85.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.675 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.78 -40.57 95.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.43 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.95 -55.6 31.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.612 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -59.39 -37.13 77.19 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.776 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 243' ' ' PHE . . . . . 0.557 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.4 OUTLIER -63.33 -45.92 89.02 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.938 178.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 244' ' ' ARG . . . . . 0.445 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 45.0 ttm180 -60.91 -45.02 96.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.071 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -65.93 -46.56 77.78 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 51.8 tp10 -59.67 -47.42 85.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . 0.557 HD23 ' O ' ' A' ' 243' ' ' PHE . 2.4 mm? -63.73 -39.39 94.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.798 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 86.5 tttt -54.81 -48.1 73.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.165 0.507 . . . . 0.0 110.115 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -67.74 -37.96 82.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -61.05 -49.56 76.88 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.833 0.349 . . . . 0.0 111.066 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 251' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 16.1 pt-20 -62.41 -35.4 79.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.894 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.11 92.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.386 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.29 -50.78 68.76 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.978 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -30.36 49.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.176 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -64.54 -46.39 83.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 110.172 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -62.89 -44.45 96.06 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.349 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -57.61 -42.99 84.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.253 179.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -61.15 -40.79 95.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.133 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 259' ' ' HIS . . . . . 0.533 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 81.9 t60 -59.43 -47.08 86.86 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.27 0.557 . . . . 0.0 110.279 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -62.44 -36.23 81.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.371 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 261' ' ' GLN . . . . . 0.643 HE21 ' CG2' ' A' ' 297' ' ' THR . 83.2 mm-40 -61.71 -42.37 98.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.214 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -60.62 -47.66 85.21 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 263' ' ' GLN . . . . . 0.533 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 3.7 mp0 -65.78 -37.67 86.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.166 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.73 -43.5 98.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.248 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -62.81 -48.93 76.99 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.13 0.49 . . . . 0.0 110.424 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 70.3 mt -62.3 -43.0 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.901 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.54 76.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -63.88 -49.29 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.279 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.75 -44.03 82.53 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.037 0.446 . . . . 0.0 110.672 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -62.39 -45.75 91.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.572 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 42.8 tp -62.05 -42.46 99.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.785 0.326 . . . . 0.0 110.344 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -57.25 -42.8 82.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.277 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -80.14 -26.92 39.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.528 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.55 -38.14 90.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.735 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -53.73 -20.91 6.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.548 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 73.5 m -62.37 -37.18 84.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.73 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.0 t -61.01 -45.22 98.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.49 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 98.74 17.78 27.24 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -82.5 106.63 14.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.823 0.344 . . . . 0.0 110.462 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.21 91.8 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -61.63 -53.93 49.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.769 0.319 . . . . 0.0 110.632 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -68.2 -43.88 77.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.778 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 283' ' ' VAL . . . . . 0.577 ' CG1' ' NH1' ' A' ' 287' ' ' ARG . 41.8 t -61.85 -48.28 89.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.701 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 42.9 t -62.99 -46.04 89.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.777 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -63.25 -41.33 99.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.788 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 55.4 m -59.64 -45.3 92.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.398 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 287' ' ' ARG . . . . . 0.577 ' NH1' ' CG1' ' A' ' 283' ' ' VAL . 59.6 mtt85 -64.03 -38.16 90.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.975 0.417 . . . . 0.0 110.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -57.76 -60.98 2.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.393 0.616 . . . . 0.0 110.238 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -63.34 -40.46 97.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.043 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -42.62 -52.49 4.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.182 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.09 -37.63 78.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.677 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 22.8 tp -61.41 -52.28 65.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.587 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.83 -42.05 97.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.251 0.548 . . . . 0.0 109.991 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 294' ' ' GLU . . . . . 0.509 ' O ' ' OG1' ' A' ' 297' ' ' THR . 82.3 tt0 -62.25 -35.34 78.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.695 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.47 -44.81 94.69 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -59.58 -43.48 93.63 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.09 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 297' ' ' THR . . . . . 0.643 ' CG2' HE21 ' A' ' 261' ' ' GLN . 36.0 p -60.5 -42.19 95.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.243 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -63.73 -45.12 91.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.434 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -60.92 -44.15 97.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.305 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -42.74 99.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.962 0.411 . . . . 0.0 110.429 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.28 -43.23 95.66 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -62.15 -42.86 99.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.399 . . . . 0.0 110.449 178.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 10.5 m -61.25 -44.96 96.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.482 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.56 -43.27 90.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.972 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -59.33 -49.6 77.2 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.626 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -62.9 -43.56 98.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.341 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 307' ' ' HIS . . . . . 0.538 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.58 -37.05 85.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.138 179.321 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 308' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 312' ' ' SER . 11.8 mt -61.34 -41.87 97.75 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.436 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -68.52 -58.84 3.71 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.05 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.11 -48.79 78.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.265 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 311' ' ' LEU . . . . . 0.538 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 12.4 tp -61.0 -42.78 99.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.703 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 312' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 67.2 p -61.67 -36.11 79.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.519 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.26 -44.96 89.69 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 87.0 mtm180 -63.2 -43.46 98.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.738 0.304 . . . . 0.0 110.855 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 2.1 mm -74.09 -15.79 16.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.692 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 6.1 t -53.49 -48.65 68.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.262 0.553 . . . . 0.0 109.726 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.76 -176.867 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 88.0 t80 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 t -61.27 -44.09 97.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.069 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 54.5 ttm-85 55.31 78.39 0.19 Allowed 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.648 ' O ' ' N ' ' A' ' 6' ' ' ASN . 96.7 mt-10 -61.99 -32.96 73.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.894 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.6 tttp 48.26 -79.08 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.602 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.648 ' N ' ' O ' ' A' ' 4' ' ' GLU . 0.6 OUTLIER -149.83 166.81 28.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.648 0.261 . . . . 0.0 110.375 179.669 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -176.36 58.75 0.17 Allowed Pre-proline 0 N--CA 1.463 0.179 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.769 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.63 148.18 92.41 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 122.367 2.045 . . . . 0.0 111.915 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.5 tttt -171.24 56.55 0.24 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.594 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.22 155.87 63.45 Favored 'Trans proline' 0 C--N 1.308 -1.593 0 C-N-CA 122.655 2.237 . . . . 0.0 112.08 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.7 p -45.72 142.72 3.44 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.684 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.13 149.7 36.56 Favored 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 122.694 2.262 . . . . 0.0 112.043 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -139.16 147.64 42.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.438 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 40.88 80.37 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.063 0.459 . . . . 0.0 110.68 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -73.63 2.46 8.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.441 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 30.9 p -154.26 160.22 41.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.611 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 175.42 175.83 43.18 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.936 -0.865 . . . . 0.0 110.936 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -86.88 129.31 34.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.788 0.328 . . . . 0.0 110.529 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -89.02 -64.69 1.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.784 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -93.81 153.35 18.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.52 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.485 ' C ' ' SD ' ' A' ' 22' ' ' MET . 73.2 ttp85 -67.77 -18.68 64.95 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.525 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.486 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -115.32 137.14 52.35 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.206 0.526 . . . . 0.0 111.102 -179.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.94 -36.49 84.55 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.474 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HA ' HE21 ' A' ' 27' ' ' GLN . 63.9 tttp -60.72 -47.35 86.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.106 0.479 . . . . 0.0 110.26 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.77 -38.25 87.35 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.486 ' ND2' ' O ' ' A' ' 22' ' ' MET . 57.7 m-80 -62.32 -40.69 97.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.972 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.552 HE21 ' HA ' ' A' ' 24' ' ' LYS . 34.3 mt-30 -60.84 -45.7 93.48 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.722 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.22 -41.03 96.15 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.032 0.444 . . . . 0.0 109.973 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -57.96 -44.71 87.2 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.121 0.486 . . . . 0.0 109.787 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -60.48 -37.46 81.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.577 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 73.5 mmtt -61.38 -42.53 98.87 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.255 0.55 . . . . 0.0 109.678 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.72 -37.31 86.05 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.149 -0.621 . . . . 0.0 110.113 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -61.15 -46.37 90.82 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.254 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.577 ' HG2' ' O ' ' A' ' 31' ' ' LYS . 53.6 ptt85 -66.19 -35.1 79.57 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.119 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.36 -38.63 91.91 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.051 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.77 110.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.707 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 mt -132.69 154.59 81.54 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.741 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_exo -42.54 154.3 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.415 2.077 . . . . 0.0 112.487 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.12 -46.86 22.87 Favored 'Trans proline' 0 N--CA 1.497 1.73 0 C-N-CA 122.615 2.21 . . . . 0.0 112.51 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.472 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 62.2 t -64.14 -46.46 93.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.726 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -64.06 -41.86 97.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.133 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.97 -44.2 97.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.61 90.47 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.71 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.472 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 1.7 mp0 -67.73 -46.94 70.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.84 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.16 -46.92 84.91 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.023 0.44 . . . . 0.0 110.489 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -59.27 -42.32 90.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.05 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.566 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.62 -47.64 84.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.939 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -56.01 -47.13 78.34 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.68 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.32 -40.86 87.61 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -59.4 -39.34 83.1 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.842 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 47' ' ' ALA . 40.6 mm -62.33 -43.7 98.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -55.5 -44.71 76.84 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.267 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -60.08 -46.53 89.28 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.088 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -60.66 -44.48 96.38 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.364 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -61.07 -37.45 82.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.311 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -60.44 -45.1 94.89 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.26 -42.01 97.9 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.213 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.54 94.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.014 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -58.6 -43.53 89.59 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.759 0.314 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -60.2 -46.57 89.26 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.012 0.434 . . . . 0.0 110.044 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.79 -39.57 94.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.786 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.6 mt -61.57 -43.17 99.36 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.27 -37.02 85.99 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.13 -44.91 96.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.907 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.47 -36.84 85.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.134 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.63 71.56 0.99 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 88.4 mt -131.75 -54.14 1.0 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.757 0.313 . . . . 0.0 110.814 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 48.6 p-10 -58.58 141.36 52.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.453 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -148.17 -49.78 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.621 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -65.51 -29.38 70.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.55 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.99 11.82 80.68 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.681 -0.967 . . . . 0.0 110.681 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -64.05 -34.75 78.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.37 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.1 -50.1 75.35 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.088 0.47 . . . . 0.0 109.857 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -61.4 -41.89 97.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.188 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.23 89.85 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.382 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -62.5 -42.74 99.71 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.642 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.16 -43.45 98.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.522 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.9 -44.53 98.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 121.094 0.473 . . . . 0.0 109.966 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -59.87 -41.12 90.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.098 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.78 -39.34 94.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.39 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.43 -49.14 78.95 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.39 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -64.31 -39.02 93.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.512 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.18 -46.21 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.835 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.44 HD12 HG22 ' A' ' 84' ' ' ILE . 96.7 mt -61.53 -47.66 92.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.183 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.3 -39.63 92.74 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.648 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.49 93.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.545 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.66 -44.54 96.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.693 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -69.49 -26.0 64.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.32 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.03 28.07 71.05 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 85.4 mt -96.59 6.62 48.34 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.898 0.38 . . . . 0.0 110.68 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -73.25 54.9 0.43 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.225 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.57 140.78 23.04 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -150.26 151.75 33.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.699 0.285 . . . . 0.0 110.625 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -139.52 146.69 40.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.318 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -69.19 141.78 54.44 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.414 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.41 ' O ' ' O ' ' A' ' 97' ' ' ARG . . . -164.3 -47.6 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.71 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.41 ' O ' ' O ' ' A' ' 96' ' ' ALA . 59.6 ttm-85 45.91 96.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.641 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -53.09 165.34 0.32 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.778 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 74.3 t -61.95 -45.38 98.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.442 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.74 160.09 25.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.557 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.7 t -155.09 155.69 34.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.562 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.414 ' C ' ' N ' ' A' ' 104' ' ' LEU . 88.7 m-20 -62.83 -41.23 99.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.529 ' OG ' ' O ' ' A' ' 103' ' ' SER . 0.3 OUTLIER 45.51 21.32 0.07 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.978 0.418 . . . . 0.0 110.436 179.684 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.431 ' CD1' ' C ' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -76.96 -72.02 0.37 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.76 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.4 ' O ' ' O ' ' A' ' 104' ' ' LEU . 0.7 OUTLIER 60.11 145.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.692 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 161.18 66.34 0.02 OUTLIER Glycine 0 CA--C 1.523 0.592 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.7 t -140.08 -171.77 3.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.85 0.357 . . . . 0.0 110.527 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -62.68 136.27 57.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.876 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -85.54 126.57 33.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.282 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -149.03 159.73 43.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.608 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -171.07 -69.9 0.04 OUTLIER Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 27.6 mt -116.67 131.16 57.02 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.736 0.303 . . . . 0.0 110.234 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -122.19 -40.64 2.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.742 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -83.0 124.87 76.2 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.635 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -51.53 -38.37 64.43 Favored 'Trans proline' 0 N--CA 1.495 1.605 0 C-N-CA 122.367 2.045 . . . . 0.0 112.469 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.488 ' HG3' ' H ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.36 -42.65 96.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.948 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.488 ' H ' ' HG3' ' A' ' 116' ' ' ARG . 98.3 mt -64.93 -39.74 93.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.976 0.417 . . . . 0.0 110.227 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.5 mt-10 -62.13 -30.39 71.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.579 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.75 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.1 mttt -62.93 -50.45 70.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.747 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 32.5 mt -68.08 -43.83 77.63 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.461 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 8.0 t-105 -60.41 -51.3 70.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 -179.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.524 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -70.08 -37.55 75.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.026 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.75 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.5 OUTLIER -55.45 -50.87 68.71 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.463 -178.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.586 ' C ' ' HB2' ' A' ' 130' ' ' PHE . . . -72.5 -46.93 52.4 Favored 'General case' 0 C--O 1.246 0.886 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.288 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -47.15 -33.91 5.64 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.46 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -106.15 -35.43 7.22 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.986 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.59 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 36.9 m -50.72 -24.84 3.69 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.279 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -153.89 -95.8 0.12 Allowed Glycine 0 CA--C 1.525 0.703 0 C-N-CA 119.686 -1.245 . . . . 0.0 111.824 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.738 ' O ' ' N ' ' A' ' 131' ' ' SER . 68.8 mttm -150.93 25.27 0.74 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.372 0.605 . . . . 0.0 110.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.586 ' HB2' ' C ' ' A' ' 124' ' ' ALA . 21.9 m-85 -49.72 60.82 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.186 -1.37 . . . . 0.0 111.14 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.738 ' N ' ' O ' ' A' ' 129' ' ' LYS . 30.3 p -70.1 146.44 50.89 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.446 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . -37.03 -18.56 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.178 -173.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.632 ' N ' ' O ' ' A' ' 131' ' ' SER . 48.8 mt-10 -74.31 -46.14 42.9 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 118.927 -1.109 . . . . 0.0 108.497 176.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' A' ' 131' ' ' SER . 80.4 mm-40 -75.62 -42.36 51.85 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.354 178.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.438 ' CD1' ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -60.07 -37.47 79.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.446 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 54.5 m-20 -61.92 -43.94 97.8 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.362 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -58.92 -45.16 91.05 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 119.881 -0.727 . . . . 0.0 109.9 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.442 ' O ' ' CG ' ' A' ' 141' ' ' GLU . 4.5 mm? -61.01 -40.37 93.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 178.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.559 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -65.12 -31.53 72.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 176.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.567 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 84.5 mmt-85 -57.6 -48.51 79.19 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.245 -0.982 . . . . 0.0 108.358 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.442 ' CG ' ' O ' ' A' ' 138' ' ' LEU . 9.4 pt-20 -71.46 -34.16 69.98 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.964 -0.694 . . . . 0.0 111.912 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.2 m-85 -56.15 -58.78 6.48 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.184 0.516 . . . . 0.0 110.242 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.41 -37.59 86.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.214 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 67.4 m170 -51.51 -42.7 61.9 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 119.677 -0.809 . . . . 0.0 109.388 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.88 -41.67 91.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.396 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -61.29 -44.15 97.7 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.31 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -68.05 -49.19 62.9 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -61.37 -42.91 99.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.606 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.06 -45.09 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.542 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.545 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.4 m170 -61.12 -35.96 78.45 Favored 'General case' 0 C--O 1.215 -0.742 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.294 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -65.21 -46.68 79.69 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.191 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.416 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 42.1 m-85 -65.69 -44.02 87.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.837 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -70.44 -45.2 66.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.667 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.545 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 75.9 t -63.12 -45.96 97.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.905 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.72 -43.74 95.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.42 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.08 -43.59 98.12 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.588 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . 0.451 ' O ' ' OG ' ' A' ' 160' ' ' SER . 79.5 mm-40 -67.6 -28.29 67.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.984 0.421 . . . . 0.0 110.037 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 63.0 m -67.88 -49.53 61.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.88 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.527 ' CD2' HH22 ' A' ' 186' ' ' ARG . 4.2 pp -79.33 -20.78 47.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.756 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.451 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 80.4 p -60.44 -34.65 74.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.45 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.457 ' C ' ' H ' ' A' ' 163' ' ' GLU . 99.4 mtt180 -63.58 -40.75 97.75 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.101 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 11.5 p -75.49 39.73 0.16 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.643 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' A' ' 161' ' ' ARG . 71.3 mm-40 -127.02 -39.34 1.94 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.051 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.469 ' OE2' ' OE1' ' A' ' 167' ' ' GLU . 11.7 tp10 -89.94 23.48 2.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.157 0.504 . . . . 0.0 110.289 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 18.8 tt -56.6 117.26 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.056 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 34.8 m170 54.1 23.57 4.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.366 0.603 . . . . 0.0 109.465 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.469 ' OE1' ' OE2' ' A' ' 164' ' ' GLU . 48.5 tp10 45.73 81.95 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.784 178.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 167' ' ' GLU . 80.6 m-20 -158.86 112.42 2.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.137 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 6.0 m -154.48 75.14 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.76 0.314 . . . . 0.0 110.963 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 21.4 tt -172.34 135.42 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.548 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' SER . . . . . 0.599 ' O ' ' N ' ' A' ' 173' ' ' SER . 5.8 m -159.83 155.53 22.61 Favored Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.606 179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.55 65.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 122.545 2.163 . . . . 0.0 112.311 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.599 ' N ' ' O ' ' A' ' 171' ' ' SER . 16.7 m -145.32 123.79 12.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.754 0.311 . . . . 0.0 110.711 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.574 ' OD1' ' N ' ' A' ' 175' ' ' LEU . 46.6 p-10 -65.3 -37.23 86.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.413 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.574 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 0.9 OUTLIER -142.79 45.85 1.58 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.038 0.447 . . . . 0.0 109.938 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 6.2 m 57.66 -86.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.231 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.522 ' N ' ' OD1' ' A' ' 177' ' ' ASP . 13.1 p-10 174.64 123.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.675 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.81 128.4 70.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.833 0.349 . . . . 0.0 110.655 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -124.47 5.38 8.32 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.777 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 109.05 126.7 5.37 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.807 ' N ' ' NE2' ' A' ' 184' ' ' HIS . 3.1 t 56.56 56.37 5.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.88 0.371 . . . . 0.0 110.189 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 6.2 t -138.87 -85.13 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.92 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 50.6 tp -93.01 -48.25 6.6 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.975 0.417 . . . . 0.0 111.258 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.807 ' NE2' ' N ' ' A' ' 181' ' ' SER . 23.8 p80 -53.3 -39.43 63.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.204 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -43.92 96.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.583 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.527 HH22 ' CD2' ' A' ' 159' ' ' LEU . 3.7 tpt180 -61.21 -45.21 95.51 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.588 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 -61.72 -40.51 95.33 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.423 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 59.3 m -61.61 -44.22 97.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.174 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -63.06 -37.7 88.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.967 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.477 ' HA ' ' HZ1' ' A' ' 193' ' ' LYS . 8.5 mt -61.97 -47.85 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.592 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.465 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.7 mtpt -68.59 -40.88 80.32 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.438 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.412 ' O ' ' OG ' ' A' ' 196' ' ' SER . 80.2 tt0 -68.76 -44.95 72.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.883 -178.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.477 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 1.8 pttm -71.57 -44.46 64.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.233 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.525 ' HG ' ' N ' ' A' ' 195' ' ' ARG . 0.4 OUTLIER -69.36 -42.82 74.72 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.32 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.525 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.99 -37.56 88.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.413 ' N ' ' HD2' ' A' ' 195' ' ' ARG . 69.3 m -62.18 -44.32 96.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -65.38 -43.71 94.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.983 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -63.06 -42.47 99.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.822 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -66.04 -33.12 75.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.334 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.95 -49.51 74.83 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 23.0 mt -63.49 -40.46 97.15 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.961 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.8 -37.41 84.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -42.83 99.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.238 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.51 -41.48 97.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -64.52 -42.94 95.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.803 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.711 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -65.99 -40.29 91.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.565 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.521 ' O ' ' N ' ' A' ' 211' ' ' GLY . 22.0 t -63.65 -46.82 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.86 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.8 p -72.07 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.058 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -100.5 -14.76 18.12 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.318 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.711 ' N ' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -130.75 -39.53 1.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.045 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -75.6 49.76 2.42 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.522 ' OH ' ' C ' ' A' ' 127' ' ' SER . 0.8 OUTLIER -118.57 -170.37 1.89 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.933 0.397 . . . . 0.0 110.638 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 82.5 p -60.08 146.52 42.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.139 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 40.7 p -126.94 -177.59 4.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.384 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . 0.421 ' HG2' ' N ' ' A' ' 216' ' ' ALA . 80.8 tt0 65.22 159.14 0.11 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.182 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . 0.421 ' N ' ' HG2' ' A' ' 215' ' ' GLU . . . -56.94 138.83 53.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.682 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -77.35 -14.8 59.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.906 0.384 . . . . 0.0 110.54 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.573 ' O ' ' N ' ' A' ' 220' ' ' GLU . 82.2 m-85 -132.85 -105.3 0.25 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.9 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 219' ' ' GLU . 73.8 tt0 31.0 32.9 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.72 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 218' ' ' PHE . 12.4 mt-10 -61.33 139.86 94.66 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.521 -179.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.425 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 68.9 Cg_endo -76.88 14.63 1.25 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.582 2.188 . . . . 0.0 111.919 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -105.94 -62.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.319 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.521 HG11 ' H ' ' A' ' 224' ' ' ILE . 0.5 OUTLIER -61.11 -55.31 25.48 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 CA-C-O 121.073 0.464 . . . . 0.0 111.619 -179.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.521 ' H ' HG11 ' A' ' 223' ' ' VAL . 2.9 mm -62.75 -41.5 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 47.8 t0 -62.58 -37.7 87.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.95 0.405 . . . . 0.0 109.938 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 6.0 tp -60.19 -43.49 95.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 46.2 m0 -60.26 -38.63 84.11 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.054 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . 0.511 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 45.1 t0 -61.64 -33.83 74.63 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 178.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.647 ' O ' ' N ' ' A' ' 232' ' ' SER . 38.6 mt -64.32 -40.08 95.19 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.071 0.463 . . . . 0.0 110.695 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.521 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -24.58 -51.77 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.092 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.511 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 2.3 pt20 -58.27 -44.81 88.57 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.232 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.647 ' N ' ' O ' ' A' ' 229' ' ' LEU . 9.9 m -79.97 -7.54 58.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.377 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -81.91 10.73 5.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.928 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.6 m120 67.56 91.28 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.31 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 79.7 mt -129.73 166.34 20.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.701 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.0 p -73.46 161.56 30.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.722 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -63.99 -46.28 85.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.57 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -62.68 -46.71 86.92 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.993 0.425 . . . . 0.0 110.524 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -67.44 -37.96 83.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.557 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -63.07 -42.58 99.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.731 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -64.77 -52.83 54.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.522 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.59 -37.77 76.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.468 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -66.7 -44.14 82.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.853 178.789 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -57.3 -47.93 80.22 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.902 0.382 . . . . 0.0 110.264 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.96 -38.81 83.22 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.814 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -60.02 -49.6 77.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.944 0.402 . . . . 0.0 110.492 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.5 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 4.0 mm? -63.78 -40.33 96.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.976 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.5 -44.25 84.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.923 0.392 . . . . 0.0 110.037 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -67.01 -41.16 87.17 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.714 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -59.4 -48.89 79.9 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 120.739 0.304 . . . . 0.0 111.282 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 12.4 pt-20 -65.1 -37.65 88.17 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.76 -40.08 88.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.743 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -62.85 -45.39 92.78 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.428 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -65.05 -40.3 88.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.079 -0.649 . . . . 0.0 109.832 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.81 -44.56 96.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -61.82 -42.41 98.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.102 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -56.11 -45.49 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.24 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . 0.401 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 53.8 t-20 -59.13 -41.95 89.47 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.362 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -59.02 -45.52 90.5 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.371 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -62.18 -38.26 88.41 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.148 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.503 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 61.4 mm-40 -59.7 -42.28 92.64 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.049 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -62.07 -47.74 83.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.419 -0.513 . . . . 0.0 109.848 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -65.24 -34.09 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.111 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.43 -42.13 99.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.89 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -64.19 -47.6 79.13 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.05 -43.42 99.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.1 -38.17 82.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.975 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.82 -44.29 97.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.955 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . 0.543 ' OE2' ' NE2' ' A' ' 273' ' ' HIS . 17.3 tp10 -59.83 -44.84 93.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.136 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.09 -39.43 89.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 28.3 tp -60.3 -44.75 95.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.072 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . 0.425 ' NH2' ' OE1' ' A' ' 269' ' ' GLU . 86.6 mtm180 -61.15 -42.07 97.89 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.095 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . 0.543 ' NE2' ' OE2' ' A' ' 269' ' ' GLU . 18.1 m170 -67.85 -43.09 80.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.214 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.64 84.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.886 0.374 . . . . 0.0 110.939 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -64.3 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 7.8 t -61.95 -20.44 63.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.78 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.402 HG13 ' H ' ' A' ' 279' ' ' ASP . 91.5 t -61.3 -46.26 96.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.884 0.373 . . . . 0.0 110.413 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.72 58.04 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . 0.402 ' H ' HG13 ' A' ' 277' ' ' VAL . 91.1 m-20 -68.07 -24.06 65.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.602 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 83.78 5.74 87.73 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . 0.682 ' C ' ' H ' ' A' ' 283' ' ' VAL . 75.0 mm-40 -82.91 156.92 23.28 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 110.026 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 61.2 -17.8 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.732 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . 0.682 ' H ' ' C ' ' A' ' 281' ' ' GLU . 73.7 t -63.25 -47.4 92.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.66 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 5.9 t -64.3 -46.22 84.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.485 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -62.96 -46.25 88.62 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.927 0.394 . . . . 0.0 110.79 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 m -61.58 -42.09 98.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.529 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -64.32 -39.03 93.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.38 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -60.71 -55.3 34.84 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 8.1 mmtp -64.02 -32.8 74.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.375 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . 0.572 ' CE1' ' OE2' ' A' ' 294' ' ' GLU . 19.9 t-80 -57.82 -49.86 75.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.351 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.27 -39.12 82.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.746 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 4.4 tp -61.5 -47.13 87.02 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.341 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 1.1 mt -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.058 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.572 ' OE2' ' CE1' ' A' ' 290' ' ' HIS . 92.1 mt-10 -64.2 -36.14 83.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.12 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.92 89.42 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . 0.521 ' NH1' ' OE1' ' A' ' 299' ' ' GLU . 14.2 tpp180 -62.81 -42.7 99.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.682 0.277 . . . . 0.0 110.744 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.524 ' HG1' ' H ' ' A' ' 298' ' ' LYS . 23.4 p -59.06 -50.04 75.61 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.427 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . 0.524 ' H ' ' HG1' ' A' ' 297' ' ' THR . 52.6 tttp -63.07 -43.2 99.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.529 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . 0.521 ' OE1' ' NH1' ' A' ' 296' ' ' ARG . 83.6 tt0 -62.0 -40.54 96.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.294 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.61 95.64 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.267 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.65 -41.59 97.46 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . 0.449 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 70.1 t80 -62.15 -45.54 92.96 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.53 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 303' ' ' THR . . . . . 0.433 HG21 ' HD1' ' A' ' 307' ' ' HIS . 8.9 m -60.44 -43.4 96.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.447 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.97 -43.25 91.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 52.0 tttp -56.32 -50.41 71.55 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.342 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . 0.449 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 30.9 mtpt -62.78 -42.35 99.66 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.49 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.433 ' HD1' HG21 ' A' ' 303' ' ' THR . 6.6 m80 -61.78 -37.97 86.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . 0.487 ' O ' ' OG ' ' A' ' 312' ' ' SER . 9.4 mt -61.02 -44.61 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.277 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -68.96 -45.69 70.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.068 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -62.73 -52.07 64.68 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.536 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.04 -38.7 91.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.504 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 312' ' ' SER . . . . . 0.487 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 39.0 m -58.38 -44.61 88.99 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.381 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -73.06 -47.28 24.83 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.135 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -63.6 -45.44 90.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.743 0.306 . . . . 0.0 110.521 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . 0.551 ' O ' ' C ' ' A' ' 316' ' ' SER . 2.5 mm -70.48 -27.02 29.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.576 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.551 ' C ' ' O ' ' A' ' 315' ' ' ILE . 23.1 t -37.15 -48.62 0.84 Allowed 'General case' 0 CA--C 1.486 -1.517 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.408 ' O ' ' N ' ' A' ' 319' ' ' ARG . 59.1 ttt85 -158.31 124.1 4.54 Favored 'General case' 0 N--CA 1.428 -1.557 0 C-N-CA 116.297 -2.161 . . . . 0.0 113.249 173.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -74.32 68.95 1.56 Allowed 'General case' 0 N--CA 1.403 -2.785 0 N-CA-C 102.873 -3.01 . . . . 0.0 102.873 175.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' A' ' 317' ' ' ARG . 12.0 ptm180 -89.85 -37.46 14.43 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.78 -174.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . 0.636 ' O ' ' N ' ' A' ' 323' ' ' LEU . 0.3 OUTLIER -93.6 70.65 4.21 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.508 178.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 31.24 -102.69 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.861 -1.063 . . . . 0.0 112.859 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 25.4 mp0 -79.82 8.16 7.32 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 118.122 -1.431 . . . . 0.0 111.517 -178.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.636 ' N ' ' O ' ' A' ' 320' ' ' HIS . 14.8 mt . . . . . 0 C--O 1.221 -0.403 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.598 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.0 p -69.72 -14.51 62.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.69 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 55.49 80.97 0.12 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.505 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -134.46 21.39 3.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.627 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -71.91 139.53 48.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.68 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -162.79 75.19 0.41 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.53 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.466 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 1.5 mp0 -76.15 -54.94 1.9 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.822 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 7' ' ' GLN . 97.8 Cg_exo -37.75 134.73 0.57 Allowed 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.53 2.153 . . . . 0.0 111.893 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.614 ' H ' ' HD2' ' A' ' 10' ' ' PRO . 8.2 tttt -121.72 -47.93 0.04 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.977 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.614 ' HD2' ' H ' ' A' ' 9' ' ' LYS . 73.0 Cg_endo -83.07 101.66 1.02 Allowed 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.413 2.076 . . . . 0.0 112.325 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.469 ' O ' ' O ' ' A' ' 10' ' ' PRO . 3.1 m 57.92 146.01 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.62 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -69.29 149.61 70.11 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.447 2.098 . . . . 0.0 112.119 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -81.48 120.37 24.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.295 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -167.52 177.19 6.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.651 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -80.62 67.95 6.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.452 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 p -80.38 163.77 23.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.685 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 158.14 42.29 0.02 OUTLIER Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -162.01 123.08 2.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.722 0.296 . . . . 0.0 110.622 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.1 tp10 -131.28 -36.59 1.28 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.517 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.483 ' H ' ' CG ' ' A' ' 26' ' ' ASN . 33.5 m-85 -91.31 -178.72 5.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.19 -19.1 61.79 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.826 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.472 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 99.2 mmm -135.1 148.0 49.69 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.242 0.544 . . . . 0.0 110.916 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -64.36 -37.16 86.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.486 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.7 -48.59 80.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.117 0.484 . . . . 0.0 110.45 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.16 -38.32 86.03 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.496 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.483 ' CG ' ' H ' ' A' ' 20' ' ' PHE . 58.1 m-80 -63.27 -39.94 95.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.196 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -61.65 -43.9 97.98 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.282 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.452 ' N ' HD21 ' A' ' 28' ' ' LEU . 2.3 mm? -62.6 -43.17 99.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.514 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 48.0 t-105 -63.01 -50.63 69.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.469 0.652 . . . . 0.0 110.346 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -56.91 -39.05 73.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.846 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -61.07 -44.37 97.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.024 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.82 88.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.806 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.622 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 76.1 mt-30 -61.14 -38.24 85.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.946 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 mmm-85 -64.12 -39.27 93.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.545 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 88.8 mt -66.04 -32.54 74.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.397 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.622 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 32.6 m170 65.86 113.87 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.752 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.2 mt -138.38 154.49 73.68 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.753 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -42.01 154.6 0.1 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.454 2.102 . . . . 0.0 112.321 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -69.41 -40.35 5.99 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.548 2.165 . . . . 0.0 112.454 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 63.1 t -63.21 -48.92 85.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.578 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -66.31 -39.42 89.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.447 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.26 -41.84 99.08 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.552 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.44 78.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.52 -42.63 87.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.9 tp -62.45 -47.46 83.94 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.152 0.501 . . . . 0.0 110.748 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.03 -41.57 96.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.273 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.554 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.16 -48.37 81.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.727 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -54.11 -48.5 70.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.865 0.364 . . . . 0.0 110.251 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.82 -40.07 83.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -59.94 -40.01 87.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.3 mm -62.53 -42.9 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.81 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.588 HE22 HD23 ' A' ' 81' ' ' LEU . 48.0 tt0 -59.67 -45.49 91.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.351 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -57.4 -48.0 80.22 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.346 0.593 . . . . 0.0 110.114 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -59.57 -43.97 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.311 0.577 . . . . 0.0 110.267 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -60.67 -40.16 91.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -58.29 -46.03 86.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.194 0.521 . . . . 0.0 109.848 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.87 -42.63 94.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.998 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.87 -45.2 95.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.549 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 82.2 t90 -56.09 -42.53 76.89 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.283 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.3 -45.95 91.58 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.205 0.526 . . . . 0.0 109.715 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -57.1 -44.63 83.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.11 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.3 mp -62.37 -40.11 95.36 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.021 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -56.46 -44.67 80.77 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 27.0 mt -62.15 -41.67 98.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.254 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -63.97 -36.13 82.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.074 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.4 69.7 1.05 Allowed Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.276 -0.729 . . . . 0.0 111.276 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 80.5 mt -127.09 -54.17 1.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.762 0.315 . . . . 0.0 110.842 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -71.48 126.69 30.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.489 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -124.76 -52.37 1.68 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.559 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -66.93 -32.86 74.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.483 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.49 18.14 53.13 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -59.69 -39.1 83.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 110.201 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -56.93 -64.26 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.079 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -48.0 -40.38 22.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.216 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.33 86.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.225 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.7 ttt85 -61.34 -41.1 96.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.447 HD13 ' N ' ' A' ' 77' ' ' LEU . 11.0 mp -61.89 -44.15 97.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.146 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.41 -45.77 92.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.293 0.568 . . . . 0.0 109.97 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.422 ' O ' ' CG2' ' A' ' 83' ' ' VAL . 40.7 mmm-85 -61.79 -38.9 89.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.962 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.409 ' O ' HG13 ' A' ' 84' ' ' ILE . 38.0 t30 -64.02 -40.48 96.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.185 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.588 HD23 HE22 ' A' ' 52' ' ' GLN . 0.2 OUTLIER -59.64 -49.86 76.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.311 0.577 . . . . 0.0 109.97 -179.392 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -66.17 -37.51 85.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.549 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.462 ' CG1' ' HZ3' ' A' ' 87' ' ' LYS . 54.4 t -62.52 -46.57 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.653 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 80' ' ' ASN . 80.4 mt -61.35 -46.95 95.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.391 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.6 mt -65.31 -39.35 92.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.911 0.386 . . . . 0.0 110.555 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.34 -48.21 82.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.866 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.462 ' HZ3' ' CG1' ' A' ' 83' ' ' VAL . 47.3 mttp -62.73 -45.33 93.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.776 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -64.35 -30.21 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.376 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.31 9.67 83.41 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.8 mt -90.78 1.79 56.6 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.811 0.338 . . . . 0.0 110.349 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.425 ' CG ' ' N ' ' A' ' 92' ' ' GLY . 16.4 p-10 -61.37 -49.77 75.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.772 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.425 ' N ' ' CG ' ' A' ' 91' ' ' ASP . . . 158.85 -161.0 31.58 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.431 ' HG2' ' H ' ' A' ' 95' ' ' ASP . 82.9 tttt -140.17 144.94 36.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 0.0 110.409 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -132.29 37.75 3.52 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.582 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.431 ' H ' ' HG2' ' A' ' 93' ' ' LYS . 47.6 m-20 59.98 113.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.56 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -149.03 141.24 24.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.407 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.706 ' O ' ' N ' ' A' ' 99' ' ' VAL . 83.3 mtp180 -63.08 -45.2 93.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.666 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 55.19 -65.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.073 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.706 ' N ' ' O ' ' A' ' 97' ' ' ARG . 3.3 m -97.14 131.77 43.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.235 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.21 -7.2 22.36 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.484 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.592 ' O ' ' CG ' ' A' ' 102' ' ' ASN . 42.4 t -61.29 -41.75 97.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.494 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.592 ' CG ' ' O ' ' A' ' 101' ' ' SER . 16.8 p30 51.84 41.13 29.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.716 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.497 ' O ' ' O ' ' A' ' 104' ' ' LEU . 2.3 p -136.84 139.2 41.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.31 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.497 ' O ' ' O ' ' A' ' 103' ' ' SER . 4.1 mm? 55.78 152.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.319 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 88.3 p -62.88 -22.22 66.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.699 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.07 11.47 78.65 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.2 p -66.92 111.86 4.01 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -141.73 174.21 10.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.34 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 61.67 71.31 0.55 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.905 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -149.92 93.81 2.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.342 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -125.39 -120.26 2.43 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.771 -0.931 . . . . 0.0 110.771 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.403 ' N ' ' CD2' ' A' ' 112' ' ' LEU . 4.4 mm? -109.6 128.46 55.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.051 0.453 . . . . 0.0 110.933 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -67.61 -42.7 81.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.423 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -79.77 132.89 59.79 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.639 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.8 -24.34 34.51 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.657 2.238 . . . . 0.0 112.141 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -64.21 -45.17 89.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.301 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.5 mt -68.38 -36.67 79.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.081 0.467 . . . . 0.0 110.439 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.609 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.0 mt-10 -55.89 -24.86 39.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.428 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.55 -49.87 74.93 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.78 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.488 HD22 ' CZ ' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -71.42 -46.68 59.5 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.146 0.498 . . . . 0.0 111.782 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 19.3 t-105 -55.89 -46.06 78.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.506 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.609 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.3 m-70 -71.19 -34.07 70.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.539 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.577 ' O ' ' OG ' ' A' ' 127' ' ' SER . 10.3 tptt -55.54 -51.38 67.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.079 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -75.34 -47.15 29.05 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.974 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -50.77 -39.55 52.69 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.747 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.3 m -94.1 -41.72 9.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.875 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.577 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 15.8 m -44.6 -27.11 0.44 Allowed 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -156.54 -97.08 0.13 Allowed Glycine 0 N--CA 1.462 0.373 0 C-N-CA 119.611 -1.281 . . . . 0.0 111.128 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.679 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.6 mttt -157.46 20.76 0.29 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.579 ' CE1' ' OE1' ' A' ' 134' ' ' GLU . 3.2 m-85 -60.12 50.05 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.671 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.679 ' N ' ' O ' ' A' ' 129' ' ' LYS . 0.1 OUTLIER -107.89 114.94 29.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.983 0.42 . . . . 0.0 111.705 -179.285 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 136' ' ' ASP . . . 120.51 -98.06 0.67 Allowed Glycine 0 CA--C 1.524 0.641 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.136 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.563 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 54.2 mp0 -78.79 -40.03 34.21 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.2 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.579 ' OE1' ' CE1' ' A' ' 130' ' ' PHE . 44.2 mt-10 -64.15 -43.55 94.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.563 0.697 . . . . 0.0 110.008 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 130' ' ' PHE . 1.6 mt -68.77 -35.62 77.29 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.275 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.517 ' CG ' ' N ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -62.36 -49.03 77.18 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.367 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 136' ' ' ASP . 18.6 ptpt -59.96 -38.52 82.73 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.465 ' N ' ' HG3' ' A' ' 137' ' ' LYS . 6.6 mt -59.84 -42.61 94.0 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.24 -39.19 78.64 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.583 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 81.9 mtp180 -54.45 -42.95 71.21 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.125 -1.03 . . . . 0.0 108.397 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -72.2 -39.4 68.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.728 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.488 ' CZ ' HD22 ' A' ' 120' ' ' LEU . 0.2 OUTLIER -59.76 -58.95 6.34 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.722 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.1 -41.01 97.76 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.583 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 36.4 m170 -57.62 -41.4 81.25 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.534 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.506 ' O ' ' CG2' ' A' ' 149' ' ' VAL . 10.5 m-70 -64.33 -39.7 94.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.627 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -59.55 -47.64 84.75 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.488 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.556 ' HA ' ' HD1' ' A' ' 150' ' ' HIS . 99.2 mt-10 -68.43 -53.48 23.31 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.631 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.56 -40.93 96.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.997 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.506 ' CG2' ' O ' ' A' ' 145' ' ' HIS . 41.3 t -62.59 -44.17 99.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.173 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.689 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 0.8 OUTLIER -65.58 -38.96 91.02 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.576 -0.85 . . . . 0.0 109.312 -178.966 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.68 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 97.1 mt-10 -58.87 -45.94 88.98 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.125 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.493 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 2.5 m-85 -62.55 -43.6 98.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.654 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.99 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.049 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 12.8 t -60.24 -46.4 94.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 18.3 mt -63.17 -45.58 91.17 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 0.0 110.643 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.497 ' N ' HD22 ' A' ' 156' ' ' LEU . 2.0 mm? -64.53 -41.52 96.32 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.439 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -67.58 -27.25 66.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.843 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 62.0 m -69.13 -46.71 66.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.723 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 160' ' ' SER . 4.1 pp -79.12 -20.97 47.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.68 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.481 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 66.4 m -66.69 -41.33 88.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.153 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -59.92 -46.93 87.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.127 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.693 ' C ' ' H ' ' A' ' 164' ' ' GLU . 1.7 t -79.28 -174.06 3.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.322 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.533 ' N ' ' OG1' ' A' ' 162' ' ' THR . 92.4 mt-10 65.89 -28.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.977 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.693 ' H ' ' C ' ' A' ' 162' ' ' THR . 77.2 tt0 -99.81 40.36 1.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.189 0.519 . . . . 0.0 109.7 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 8.9 tp -135.05 136.99 51.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.289 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -124.06 48.74 1.86 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -110.4 37.2 2.8 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.253 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -144.38 -85.97 0.13 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.583 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 79.7 t -142.19 135.77 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.877 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 14.1 tt -121.73 125.61 73.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.586 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.37 165.13 18.17 Favored Pre-proline 0 C--N 1.331 -0.197 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.328 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.1 131.98 41.39 Favored 'Trans proline' 0 C--N 1.307 -1.617 0 C-N-CA 122.535 2.157 . . . . 0.0 111.964 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.769 ' OG ' ' N ' ' A' ' 177' ' ' ASP . 25.1 p -143.42 -20.13 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.501 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 25.5 t0 64.06 -28.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.614 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.69 ' H ' ' C ' ' A' ' 173' ' ' SER . 14.8 mt -100.87 28.41 5.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.479 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.468 ' C ' ' CG ' ' A' ' 177' ' ' ASP . 0.1 OUTLIER 61.44 35.23 17.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.497 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.769 ' N ' ' OG ' ' A' ' 173' ' ' SER . 0.4 OUTLIER 44.61 89.52 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.453 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 10.7 pt -129.5 153.47 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.528 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -64.32 -41.8 96.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.605 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -108.13 139.91 15.28 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 13.8 t -62.06 -45.85 91.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.867 0.365 . . . . 0.0 110.701 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.689 ' C ' ' H ' ' A' ' 184' ' ' HIS . 10.7 t -74.05 -83.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.657 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 59.2 tp 59.39 -36.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.06 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.689 ' H ' ' C ' ' A' ' 182' ' ' VAL . 3.2 p80 -56.76 -44.72 82.05 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.658 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.612 ' N ' ' CG ' ' A' ' 184' ' ' HIS . 11.8 t -65.68 -43.36 89.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.927 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.518 ' O ' HD12 ' A' ' 190' ' ' LEU . 65.2 ttt180 -61.89 -47.48 84.8 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.636 -178.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . 0.588 ' C ' ' ND1' ' A' ' 187' ' ' HIS . 0.3 OUTLIER -71.39 -31.0 66.79 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.283 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 184' ' ' HIS . 57.5 m -62.55 -45.08 94.56 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.093 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.76 -39.15 93.58 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.389 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 186' ' ' ARG . 4.6 mp -62.34 -41.89 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.033 0.444 . . . . 0.0 110.51 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -68.78 -33.78 74.46 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.846 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.588 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -67.8 -46.07 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.142 0.496 . . . . 0.0 111.685 -179.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.539 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 pttt -72.03 -44.67 63.02 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.536 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.01 -41.3 97.51 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.558 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 192' ' ' GLU . 0.4 OUTLIER -66.04 -35.6 80.98 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.539 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 55.6 p -59.93 -39.68 86.33 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 70.2 mt -63.84 -43.59 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.26 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -62.25 -41.05 98.09 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.48 0.657 . . . . 0.0 109.303 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.554 ' NE2' ' NE ' ' A' ' 195' ' ' ARG . 86.1 mt-30 -61.95 -39.26 91.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.091 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.74 -39.63 95.54 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.72 -42.59 99.73 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.75 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 0.5 OUTLIER -63.1 -37.17 86.13 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.099 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.579 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 1.9 tmm_? -63.26 -41.75 99.08 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.325 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.83 -40.55 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.157 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.86 -43.68 98.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.511 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.682 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.1 mtt180 -63.7 -37.01 85.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.186 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.536 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 45.2 t -63.6 -45.33 97.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.093 0.473 . . . . 0.0 110.134 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -67.0 -29.38 69.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.63 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -94.32 -45.41 7.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.531 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 206' ' ' ARG . 46.1 tt0 -98.83 -31.4 11.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.141 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.536 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . -77.48 14.0 10.17 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.484 ' C ' ' CD1' ' A' ' 212' ' ' TYR . 2.1 t80 -60.41 -47.0 87.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.059 0.456 . . . . 0.0 110.535 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 26.6 t -175.58 45.94 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.76 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' ' 210' ' ' GLN . 37.4 p -138.93 161.06 38.25 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.655 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -138.36 145.76 41.48 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.543 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -166.36 120.98 1.14 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.193 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -175.33 37.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.234 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.653 ' CE2' ' NH2' ' A' ' 222' ' ' ARG . 79.3 m-85 -87.29 93.4 9.38 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 120.394 -0.523 . . . . 0.0 110.05 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -157.39 -43.34 0.07 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.178 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.87 158.24 54.53 Favored Pre-proline 0 N--CA 1.464 0.24 0 C-N-CA 120.776 -0.369 . . . . 0.0 110.556 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -54.65 128.38 30.06 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.391 2.061 . . . . 0.0 112.087 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.653 ' NH2' ' CE2' ' A' ' 218' ' ' PHE . 62.7 ttp180 179.05 -95.88 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.519 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.51 HG21 ' HE ' ' A' ' 222' ' ' ARG . 5.0 t -61.53 -51.38 73.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-O 121.548 0.69 . . . . 0.0 110.585 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.4 HG13 ' CZ3' ' A' ' 227' ' ' TRP . 1.7 mt -66.05 -28.41 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.749 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -63.79 -40.7 97.29 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 13.7 mt -62.31 -40.94 97.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.026 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . 0.547 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 20.6 m0 -59.52 -38.6 81.39 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.095 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . 0.492 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 46.3 m-20 -63.5 -38.18 90.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.567 ' O ' ' N ' ' A' ' 232' ' ' SER . 89.1 mt -62.39 -41.55 98.74 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.129 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.475 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -32.75 -34.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.074 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.552 ' CG ' ' N ' ' A' ' 232' ' ' SER . 7.6 pt20 -66.26 -46.24 77.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.728 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.567 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.0 m -89.1 -6.75 56.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.362 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -72.99 9.54 1.15 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . 0.453 ' H ' ' C ' ' A' ' 232' ' ' SER . 58.8 t30 69.19 89.84 0.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.165 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 79.6 mt -132.03 -173.25 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.687 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 62.1 p -84.38 164.77 18.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.6 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . 0.482 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 21.7 p-10 -73.81 -46.2 46.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.61 -46.58 89.21 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.171 0.51 . . . . 0.0 110.469 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -61.22 -35.82 78.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.707 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 2.8 mt -64.56 -39.76 94.33 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.69 -52.55 62.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.25 95.33 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.583 -0.447 . . . . 0.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.46 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.2 OUTLIER -70.02 -32.88 71.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.304 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -62.56 -55.75 24.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.125 0.488 . . . . 0.0 110.31 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -65.51 -37.46 86.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.541 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -56.76 -50.21 72.95 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.218 0.532 . . . . 0.0 110.377 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.514 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.0 mm? -63.96 -39.54 94.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.741 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -54.76 -47.27 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.146 0.498 . . . . 0.0 110.475 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -67.32 -39.39 85.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.614 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -59.69 -49.77 76.46 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.018 0.437 . . . . 0.0 111.364 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.0 pt-20 -63.72 -37.34 86.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.932 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.86 88.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -61.42 -51.47 68.62 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.093 0.473 . . . . 0.0 111.006 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -66.31 -35.35 74.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.201 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.72 -44.54 95.94 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.324 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.2 -43.96 97.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.02 -44.36 82.79 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.093 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -60.91 -40.49 93.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.45 -48.59 81.08 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 110.444 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -62.81 -35.66 80.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.588 HE21 ' CG2' ' A' ' 297' ' ' THR . 76.6 mm-40 -60.88 -44.48 97.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.183 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.98 -48.3 80.95 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.8 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -64.16 -34.1 77.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.866 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.25 -41.97 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.856 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.16 -45.5 84.68 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.554 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.2 mt -62.63 -43.4 98.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.118 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.36 88.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.209 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -60.92 -46.02 92.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.12 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.22 -45.99 91.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.136 0.493 . . . . 0.0 110.279 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.75 -40.14 94.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.447 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 5.0 tt -59.17 -43.69 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.095 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -62.31 -41.08 98.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.269 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -66.81 -44.22 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.42 -36.92 85.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.627 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.03 -26.08 68.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 35.9 t -60.58 -39.83 89.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.376 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.42 -43.48 94.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.275 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.71 8.93 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . 0.406 ' C ' ' H ' ' A' ' 281' ' ' GLU . 47.4 m-20 -63.8 -42.88 97.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.732 0.301 . . . . 0.0 110.654 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 70.26 -3.85 9.96 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . 0.406 ' H ' ' C ' ' A' ' 279' ' ' ASP . 47.8 tp10 -96.98 -56.58 2.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 110.472 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -80.88 -15.95 54.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.746 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.51 -47.13 93.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.655 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 43.8 t -63.87 -43.99 94.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -59.73 -47.49 85.43 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.589 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 15.2 t -63.03 -45.87 90.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -63.96 -38.82 92.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.669 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.97 -57.85 11.26 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.155 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -64.32 -35.58 81.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.12 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -51.41 -52.95 41.6 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.268 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.25 -36.16 79.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.663 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.74 -52.03 66.83 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.374 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 14.8 tp -62.74 -42.85 99.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.451 0.643 . . . . 0.0 109.923 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.63 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.6 tt0 -64.7 -33.24 75.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.876 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -65.08 -47.58 80.29 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . 0.535 ' HG3' ' N ' ' A' ' 297' ' ' THR . 0.0 OUTLIER -62.36 -36.98 83.93 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.63 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 16.1 p -61.51 -44.11 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.43 -43.72 98.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.215 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.66 -37.7 88.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.122 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -44.46 96.23 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.1 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.31 99.57 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -60.22 -44.56 95.08 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.144 0.497 . . . . 0.0 110.365 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.0 m -61.04 -42.76 99.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.381 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.1 -43.16 88.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.031 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -59.91 -49.75 76.47 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.203 0.525 . . . . 0.0 110.464 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -63.3 -42.42 99.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.55 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.35 -37.5 87.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.898 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . 0.447 ' O ' ' CB ' ' A' ' 312' ' ' SER . 12.2 mt -61.52 -42.45 98.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.489 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -65.78 -60.75 2.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.96 0.41 . . . . 0.0 111.374 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -60.63 -48.34 82.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.392 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 307' ' ' HIS . 9.1 tp -61.72 -40.73 96.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.563 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 312' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 11.4 t -59.2 -44.69 92.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.346 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.35 -38.02 95.75 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -63.15 -45.05 93.7 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.6 mm -71.84 -25.52 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.88 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' A' ' 317' ' ' ARG . 28.0 p -44.03 -61.31 1.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.632 ' HE ' ' CD2' ' A' ' 323' ' ' LEU . 7.3 ptt-85 -67.06 -38.86 86.56 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 317' ' ' ARG . . . 84.46 -34.7 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.42 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -149.63 140.14 22.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.954 0.883 . . . . 0.0 112.373 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -176.5 82.26 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 113.954 -1.476 . . . . 0.0 107.24 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 58.11 53.23 6.84 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.644 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 58.18 33.03 22.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.499 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.632 ' CD2' ' HE ' ' A' ' 317' ' ' ARG . 93.7 mt . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.582 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 86.3 t80 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 t -137.21 149.35 47.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.643 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 88.9 mmt-85 -113.7 100.82 8.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.529 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -143.46 112.23 6.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.517 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -78.44 -75.08 0.24 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.758 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 48.49 80.85 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.479 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.583 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -90.94 162.76 32.03 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.537 -179.738 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -64.73 149.17 90.12 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.568 2.179 . . . . 0.0 112.073 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 31.8 pttt -151.55 54.46 1.36 Allowed Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.078 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 9' ' ' LYS . 34.3 Cg_endo -67.15 153.91 76.02 Favored 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 122.641 2.227 . . . . 0.0 111.856 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -176.69 -56.24 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.846 -179.707 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 11' ' ' SER . 59.7 Cg_endo -69.65 150.89 69.45 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 122.393 2.062 . . . . 0.0 111.943 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -123.74 145.81 48.74 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.544 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.5 mtp180 -78.86 151.4 31.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.336 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -114.02 168.52 9.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.505 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -71.53 160.96 31.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.782 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -153.62 -38.73 0.02 OUTLIER Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -75.41 151.58 38.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.741 0.305 . . . . 0.0 110.568 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.9 -38.15 85.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.87 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -129.19 149.67 50.9 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.569 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -87.64 -12.2 46.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.512 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 78.5 mtp -119.42 138.5 53.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.109 0.48 . . . . 0.0 111.04 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -64.44 -36.53 84.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.44 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.94 -48.31 82.23 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.545 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.0 mp -61.73 -38.36 87.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.477 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 55.5 t-20 -63.18 -39.24 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.094 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.8 tp60 -60.25 -46.55 89.41 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.348 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.72 -42.47 98.99 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.352 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -61.59 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.176 0.512 . . . . 0.0 110.533 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -58.46 -44.03 89.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.128 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.21 -41.59 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.367 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.0 88.48 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.075 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -62.06 -39.61 92.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.853 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -61.7 -41.49 97.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.347 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.16 -39.63 95.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.91 107.96 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.821 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -125.08 154.6 71.52 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.678 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -42.93 154.88 0.13 Allowed 'Trans proline' 0 N--CA 1.492 1.382 0 C-N-CA 122.507 2.138 . . . . 0.0 112.372 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.01 -43.81 53.16 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.585 2.19 . . . . 0.0 112.209 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.424 HG21 ' H ' ' A' ' 41' ' ' ARG . 2.8 m -67.36 -46.06 84.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.996 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.424 ' H ' HG21 ' A' ' 40' ' ' VAL . 21.6 mmt85 -65.37 -42.1 93.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.805 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 tp -63.92 -43.99 94.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.593 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.79 -42.76 90.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.675 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -66.96 -46.24 75.27 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.3 tp -62.94 -45.7 91.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.359 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -59.5 -41.96 91.09 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.983 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.422 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.51 -47.36 85.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.657 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -57.0 -47.21 81.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.365 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.4 mt -57.06 -41.99 79.73 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.224 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.63 -38.79 85.96 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.228 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.422 HG12 ' O ' ' A' ' 47' ' ' ALA . 4.9 mm -61.34 -43.32 96.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.529 ' NE2' HD21 ' A' ' 80' ' ' ASN . 49.1 mm-40 -58.16 -47.66 82.68 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.622 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.26 -47.4 81.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.154 0.502 . . . . 0.0 110.237 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.451 HH11 ' HD3' ' A' ' 54' ' ' ARG . 39.3 mtp-105 -62.0 -41.97 98.63 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.611 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -63.59 -36.81 85.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.413 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -60.66 -49.19 78.53 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.012 0.434 . . . . 0.0 109.999 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.83 -41.18 97.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.259 -0.577 . . . . 0.0 110.089 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.56 96.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.7 t90 -59.7 -42.59 93.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.729 0.299 . . . . 0.0 110.45 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -60.49 -45.61 93.12 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.771 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -60.72 -41.81 96.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.839 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.421 HD13 ' HZ3' ' A' ' 73' ' ' LYS . 84.4 mt -61.05 -41.23 96.21 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.8 -38.91 86.97 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.3 tt -60.34 -45.6 92.88 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -66.43 -34.65 78.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.32 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.83 30.03 8.25 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.6 mt -86.33 -49.6 7.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.732 0.301 . . . . 0.0 110.872 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.515 ' O ' ' OD1' ' A' ' 68' ' ' ASP . 49.2 p-10 -62.99 123.4 18.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.637 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -139.24 -35.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.436 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 71' ' ' GLY . 43.7 p-10 -66.21 -37.3 85.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.72 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.546 ' N ' ' OD1' ' A' ' 70' ' ' ASP . . . 88.04 0.51 83.11 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.44 -37.75 87.11 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.451 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HZ3' HD13 ' A' ' 62' ' ' LEU . 87.4 mttt -54.4 -53.91 47.75 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.003 0.43 . . . . 0.0 110.122 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -60.92 -39.13 88.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.93 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.59 -39.88 95.13 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.475 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.527 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 83.8 mt -63.09 -44.97 94.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.211 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.7 -46.34 89.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-O 121.152 0.501 . . . . 0.0 110.375 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -60.09 -43.8 95.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.977 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.529 HD21 ' NE2' ' A' ' 52' ' ' GLN . 34.5 t30 -61.73 -40.09 93.86 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.448 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.4 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.73 -48.73 80.5 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.717 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -65.17 -38.17 89.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.507 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.93 -46.89 95.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.493 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.446 HG22 HD13 ' A' ' 84' ' ' ILE . 97.1 mt -60.19 -51.07 77.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.467 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.72 -41.07 96.24 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.888 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.96 92.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.523 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -62.63 -47.76 82.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.992 0.425 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -72.78 -22.18 60.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.126 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.45 25.13 73.48 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.7 mt -87.15 -2.48 58.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.886 0.374 . . . . 0.0 110.537 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -61.85 -45.12 95.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.707 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.51 158.01 20.11 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -146.6 154.2 41.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.834 0.349 . . . . 0.0 110.898 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -135.08 -165.49 1.68 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.68 179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.426 ' O ' ' N ' ' A' ' 97' ' ' ARG . 99.7 m-20 57.33 -85.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.717 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 94' ' ' LYS . . . 56.98 -85.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.952 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.426 ' N ' ' O ' ' A' ' 95' ' ' ASP . 21.7 mmm180 -93.87 -74.03 0.55 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.363 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 54.02 80.38 0.12 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.347 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 14.5 p -127.09 131.18 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.749 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 81.2 p -138.72 154.13 48.55 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.675 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.2 t -179.14 120.0 0.07 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.509 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.626 ' CG ' ' H ' ' A' ' 103' ' ' SER . 12.8 p-10 -177.19 -85.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.947 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.626 ' H ' ' CG ' ' A' ' 102' ' ' ASN . 1.5 m 51.43 109.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.552 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.4 mp -96.24 -0.51 49.71 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.787 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 1.9 m 58.17 32.91 22.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.829 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -98.59 92.56 1.23 Allowed Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.957 -0.857 . . . . 0.0 110.957 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 11.6 t -149.1 163.46 37.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.712 0.291 . . . . 0.0 110.431 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -133.44 155.04 50.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.671 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 48.7 tp10 -153.23 136.04 15.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.499 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -151.82 116.59 5.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.767 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 172.39 -101.57 0.17 Allowed Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.489 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 73.8 mt -119.36 132.77 55.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.856 0.36 . . . . 0.0 110.647 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.468 ' OD1' ' O ' ' A' ' 113' ' ' ASP . 48.7 t0 -89.68 -26.59 20.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.452 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -82.69 114.9 55.25 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.691 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -54.44 -33.95 79.48 Favored 'Trans proline' 0 N--CA 1.498 1.775 0 C-N-CA 122.482 2.121 . . . . 0.0 112.517 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -60.51 -45.36 94.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.954 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.1 mt -68.83 -37.26 79.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.087 0.47 . . . . 0.0 110.375 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.597 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.6 mt-10 -57.97 -25.96 61.69 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.599 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 70.1 mmtt -61.53 -54.75 39.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.703 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.61 -43.98 79.15 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 13.4 t-105 -58.84 -48.91 79.68 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.478 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.597 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.7 m-70 -70.04 -33.38 71.9 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.733 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.534 ' O ' ' OG ' ' A' ' 127' ' ' SER . 11.6 tptt -56.86 -51.27 69.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.718 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.91 -47.28 59.97 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 119.596 -0.841 . . . . 0.0 111.086 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -53.71 -51.48 63.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.918 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.2 m -75.25 -43.27 52.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.73 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 9.6 m -44.48 -30.9 0.95 Allowed 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -160.54 -96.55 0.11 Allowed Glycine 0 CA--C 1.517 0.166 0 C-N-CA 119.48 -1.343 . . . . 0.0 111.526 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.693 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.6 mttt -153.63 21.43 0.53 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -59.14 50.56 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.511 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.693 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.8 p -109.17 135.4 50.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.348 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 96.43 -96.62 1.93 Allowed Glycine 0 CA--C 1.526 0.728 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.908 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.546 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 56.6 mp0 -72.71 -43.79 62.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.342 . . . . 0.0 111.166 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.514 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 46.9 mp0 -63.97 -51.77 62.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.023 0.439 . . . . 0.0 110.404 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.8 mt -61.56 -39.69 92.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.673 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -60.32 -42.81 96.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.975 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -62.04 -41.4 98.07 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 110.094 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.417 ' N ' HD13 ' A' ' 138' ' ' LEU . 9.4 mp -59.81 -41.81 92.07 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -66.54 -35.44 80.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 176.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.421 ' O ' ' CD2' ' A' ' 144' ' ' HIS . 69.9 mtp180 -55.31 -43.27 74.7 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.233 178.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -71.18 -41.19 70.65 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.824 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -60.46 -54.93 39.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.793 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.02 -39.59 90.33 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.937 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.421 ' CD2' ' O ' ' A' ' 140' ' ' ARG . 4.1 m170 -56.16 -42.68 77.41 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.401 ' HD1' HG22 ' A' ' 197' ' ' ILE . 5.7 m-70 -63.05 -40.78 98.73 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.425 178.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -61.49 -42.93 99.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.884 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.704 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 98.7 mt-10 -67.97 -46.25 71.9 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 111.555 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -70.83 -43.93 67.55 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.55 -50.62 77.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.704 ' CD2' ' O ' ' A' ' 147' ' ' GLU . 0.2 OUTLIER -70.08 -23.87 63.14 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.59 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.686 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 19.8 mm-40 -68.18 -45.0 74.64 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.417 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 16.8 m-85 -62.78 -45.35 93.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -65.5 -41.03 93.66 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.583 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.429 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 35.2 t -61.94 -46.33 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.0 0.429 . . . . 0.0 110.286 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 81.2 mt -63.44 -43.1 98.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.513 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 35.0 mt -63.19 -44.29 95.78 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.773 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -67.06 -29.88 69.79 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.972 0.415 . . . . 0.0 110.411 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 58.7 m -71.79 -47.22 54.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.297 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.545 ' O ' ' O ' ' A' ' 162' ' ' THR . 4.4 pp -79.11 -29.48 43.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.813 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 85.6 p -62.19 -41.79 98.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.619 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -74.03 -49.12 25.68 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.696 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.646 ' C ' ' H ' ' A' ' 164' ' ' GLU . 0.2 OUTLIER -97.78 176.14 5.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.398 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.466 ' H ' HG23 ' A' ' 162' ' ' THR . 50.1 mt-10 53.66 1.31 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.085 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.646 ' H ' ' C ' ' A' ' 162' ' ' THR . 68.9 tt0 -131.51 44.84 2.88 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 16.5 tt -134.68 133.26 54.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.843 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -172.12 40.24 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.46 ' HG2' ' N ' ' A' ' 168' ' ' ASN . 78.0 tt0 60.43 163.1 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.493 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.46 ' N ' ' HG2' ' A' ' 167' ' ' GLU . 58.6 t30 -69.69 108.24 3.8 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.924 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 5.4 p -155.03 124.26 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.355 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 17.3 tt -135.3 147.47 29.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.609 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.21 165.58 12.45 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 120.779 0.323 . . . . 0.0 110.415 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.83 -30.91 49.4 Favored 'Trans proline' 0 C--N 1.308 -1.603 0 C-N-CA 122.645 2.23 . . . . 0.0 112.005 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 11.4 m -51.56 114.81 1.36 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.841 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -64.73 -38.16 90.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.168 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -137.8 42.89 2.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.243 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.53 ' O ' ' OG ' ' A' ' 176' ' ' SER . 0.3 OUTLIER 54.04 19.22 1.97 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.307 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 45.27 65.71 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.208 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.463 ' CG2' ' H ' ' A' ' 181' ' ' SER . 25.0 mt -106.2 127.95 61.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.373 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -86.26 -8.74 57.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.48 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.433 ' H ' HG23 ' A' ' 178' ' ' ILE . . . 133.03 48.8 0.1 OUTLIER Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.463 ' H ' ' CG2' ' A' ' 178' ' ' ILE . 61.7 m -63.48 -85.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.622 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 6.3 t -147.35 -8.94 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.875 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 57.7 tp -62.48 -44.22 96.91 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.225 0.536 . . . . 0.0 110.735 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.476 ' CD2' ' H ' ' A' ' 185' ' ' SER . 2.2 p80 -56.92 -42.01 79.19 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.538 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.476 ' H ' ' CD2' ' A' ' 184' ' ' HIS . 71.6 m -60.33 -42.71 96.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.196 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -61.37 -41.65 97.43 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.545 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -64.9 -41.01 95.96 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.391 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 60.7 m -61.26 -44.45 97.23 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.307 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.76 -38.58 88.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.29 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.492 ' CD2' ' HZ1' ' A' ' 193' ' ' LYS . 11.4 mt -60.93 -46.86 88.98 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.539 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.507 ' HB3' HH21 ' A' ' 195' ' ' ARG . 56.5 mtpt -74.36 -32.52 62.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 11.2 tm-20 -68.08 -44.81 75.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.364 . . . . 0.0 111.296 -178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.492 ' HZ1' ' CD2' ' A' ' 190' ' ' LEU . 17.4 pttt -73.47 -43.91 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.173 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.505 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.83 -40.83 88.12 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.854 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.507 HH21 ' HB3' ' A' ' 191' ' ' LYS . 17.9 ptp180 -67.36 -38.19 84.39 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.3 p -60.31 -41.15 92.88 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . 0.401 HG22 ' HD1' ' A' ' 145' ' ' HIS . 92.1 mt -64.3 -44.63 97.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.452 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.75 -40.85 98.53 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.961 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -60.4 -41.3 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.688 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.92 -40.15 98.48 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 36.2 mt -62.04 -42.86 99.63 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.109 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.538 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.4 OUTLIER -64.14 -35.27 80.23 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.474 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.3 tmt_? -60.98 -43.77 98.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.739 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . 0.438 ' O ' ' OG ' ' A' ' 208' ' ' SER . 31.6 mt -62.26 -40.25 95.58 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -64.99 -45.08 87.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.991 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.575 ' O ' ' N ' ' A' ' 210' ' ' GLN . 82.7 mtp180 -65.21 -44.43 88.36 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.146 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.459 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -68.31 -40.87 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.131 0.491 . . . . 0.0 110.345 -179.459 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.444 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 68.4 m -60.28 -37.91 81.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.473 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -95.42 -46.66 6.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.636 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' A' ' 206' ' ' ARG . 54.9 tt0 -81.3 -35.65 30.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.109 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -90.79 58.95 3.28 Favored Glycine 0 CA--C 1.519 0.297 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.607 ' CD2' ' O ' ' A' ' 213' ' ' SER . 67.2 t80 -120.08 164.51 16.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.922 0.391 . . . . 0.0 110.532 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.607 ' O ' ' CD2' ' A' ' 212' ' ' TYR . 26.9 p -77.26 163.53 26.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.968 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 1.4 t -150.43 156.37 41.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.786 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -149.77 -178.0 6.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.282 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -142.08 -175.01 4.26 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.101 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.529 ' O ' ' HB3' ' A' ' 218' ' ' PHE . 26.1 tp10 -138.56 6.67 2.52 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.357 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.671 ' CG ' ' N ' ' A' ' 219' ' ' GLU . 68.3 t80 82.32 178.72 0.07 Allowed 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.709 ' O ' HG13 ' A' ' 223' ' ' VAL . 2.7 tm-20 74.55 52.31 0.09 Allowed 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 -176.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.507 ' O ' ' CG1' ' A' ' 223' ' ' VAL . 4.2 mp0 61.56 148.19 0.09 OUTLIER Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.226 -177.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.475 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 74.3 Cg_endo -79.3 169.99 18.11 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.396 2.064 . . . . 0.0 111.759 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 89.6 mtm180 69.59 -46.77 0.59 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.517 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.788 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 3.4 p -57.64 -97.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.798 0 CA-C-O 121.458 0.647 . . . . 0.0 111.831 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.788 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 0.3 OUTLIER -42.92 -29.07 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.333 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 223' ' ' VAL . 98.5 m-20 -62.51 -44.84 95.37 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 223' ' ' VAL . 1.5 mp -59.99 -40.18 88.28 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . 0.474 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 33.3 m0 -59.68 -43.0 94.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.783 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -67.75 -27.26 66.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.462 ' O ' ' C ' ' A' ' 230' ' ' ALA . 2.0 mt -63.08 -46.27 88.18 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.411 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.537 ' O ' ' C ' ' A' ' 231' ' ' GLN . . . -35.54 -67.25 0.16 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.814 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.537 ' C ' ' O ' ' A' ' 230' ' ' ALA . 12.8 tt0 24.62 -103.73 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.937 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.0 p -113.47 27.84 9.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.331 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.86 81.85 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.327 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -175.34 72.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.682 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.61 -169.25 2.3 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.741 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 236' ' ' THR . . . . . 0.414 ' OG1' ' OE1' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -110.46 -152.56 0.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.764 -178.902 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -92.53 -59.54 2.05 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.117 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.08 -42.8 99.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . 0.414 ' OE1' ' OG1' ' A' ' 236' ' ' THR . 89.2 mt-10 -60.18 -34.0 72.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.602 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.75 -44.4 96.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.292 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -64.89 -47.73 76.74 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.665 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.25 99.2 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.785 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.487 ' O ' ' HG2' ' A' ' 246' ' ' GLU . 1.3 t80 -61.82 -47.58 84.47 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.007 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.25 -42.53 98.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.572 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -59.09 -57.88 11.1 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.396 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 243' ' ' PHE . 13.3 pt-20 -58.99 -38.87 80.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.948 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 243' ' ' PHE . 1.9 mm? -61.55 -41.98 98.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.381 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.408 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 65.9 tttm -61.09 -42.23 98.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.157 0.503 . . . . 0.0 109.858 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -65.91 -39.5 90.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.801 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -61.84 -48.49 80.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.562 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 13.7 pt-20 -62.01 -41.87 98.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.079 0.466 . . . . 0.0 110.114 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.83 -38.2 89.82 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.152 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -61.96 -62.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.247 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.13 -37.21 13.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.03 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -65.35 -46.35 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.688 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -62.98 -43.31 99.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -58.07 -43.87 87.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.863 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.11 -40.65 94.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.252 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . 0.422 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 83.1 t60 -59.18 -47.61 84.67 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.297 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -62.7 -37.43 86.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.363 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -57.77 -47.66 81.88 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 120.993 0.425 . . . . 0.0 110.4 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -61.76 -43.24 99.25 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.042 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . 0.422 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 4.6 mp0 -60.46 -39.02 86.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.902 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.98 -41.84 98.48 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.338 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.92 -48.02 83.75 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-O 121.118 0.485 . . . . 0.0 110.44 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.3 mt -63.03 -43.49 99.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.157 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.12 85.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.27 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.53 -47.73 84.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.222 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -63.31 -45.0 93.37 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.992 0.425 . . . . 0.0 110.676 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -61.33 -42.88 99.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.469 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 1.8 tt -60.8 -42.66 98.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.907 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -59.69 -44.07 93.78 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.257 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -71.59 -34.05 69.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.88 0.371 . . . . 0.0 110.509 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . 0.407 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -62.84 -37.24 86.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.07 -25.36 66.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.871 0.367 . . . . 0.0 110.537 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 67.4 m -87.95 2.72 50.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.874 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.462 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 11.0 p -60.47 -44.47 96.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.652 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.462 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 156.9 -99.26 0.18 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -61.97 -40.93 97.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 0.0 110.258 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.5 32.81 40.9 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -66.68 -36.8 83.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.836 0.351 . . . . 0.0 110.738 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -77.49 -6.75 54.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.99 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.99 -44.99 99.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.8 t -60.5 -45.32 94.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.149 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.96 -45.84 93.14 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.992 0.425 . . . . 0.0 110.756 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 50.5 m -60.63 -41.9 95.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.182 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -62.23 -40.6 96.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.587 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.02 -57.02 14.93 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -64.62 -35.93 82.6 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.304 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -52.68 -46.99 67.47 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.47 -37.66 80.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.47 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 19.6 tp -61.25 -51.12 70.25 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.712 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.56 -41.29 98.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.044 0.45 . . . . 0.0 109.979 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -65.34 -35.04 79.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.077 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.5 -50.07 67.92 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -62.17 -42.74 99.55 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.611 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.4 m -61.28 -48.71 80.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.472 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.33 -41.93 98.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.171 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -62.28 -40.23 95.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.1 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -43.63 98.32 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.128 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.68 98.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.72 -44.61 96.58 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.043 0.449 . . . . 0.0 110.513 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.4 m -60.28 -44.44 95.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.449 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.09 -42.54 90.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.926 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.56 -51.38 70.15 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 110.809 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.67 -43.41 96.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.24 -36.41 83.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.993 0.425 . . . . 0.0 109.981 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . 0.473 ' O ' ' OG ' ' A' ' 312' ' ' SER . 12.2 mt -60.35 -44.55 95.45 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.138 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . 0.439 ' O ' ' OG ' ' A' ' 312' ' ' SER . 96.5 mm-40 -70.91 -57.3 4.72 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.543 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.86 -49.9 75.62 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.676 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 12.9 tp -62.59 -41.63 99.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.508 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 312' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 37.5 p -59.47 -40.59 87.43 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.439 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.93 -41.06 95.6 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.524 ' HE ' ' HG ' ' A' ' 323' ' ' LEU . 79.0 mtp180 -61.74 -44.62 96.55 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.724 -0.28 . . . . 0.0 110.86 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . 0.528 ' O ' ' N ' ' A' ' 318' ' ' ALA . 2.7 mm -65.01 -41.99 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.0 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.6 t -47.65 -42.67 24.99 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -97.2 5.58 49.87 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.53 ' O ' ' HB3' ' A' ' 319' ' ' ARG . . . 56.63 -89.98 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.744 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.53 ' HB3' ' O ' ' A' ' 318' ' ' ALA . 4.2 ptm180 168.57 113.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.333 -178.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -65.8 -44.03 86.9 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.49 ' O ' ' O ' ' A' ' 322' ' ' GLU . 0.1 OUTLIER -147.47 80.26 1.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.664 179.165 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.49 ' O ' ' O ' ' A' ' 321' ' ' ASN . 80.7 tt0 43.42 102.63 0.0 OUTLIER 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.993 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.524 ' HG ' ' HE ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.548 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.423 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 64.9 t80 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.7 m -62.38 -40.98 98.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.732 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.9 ttt85 -133.56 141.7 47.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.506 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -126.33 138.55 53.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.735 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -152.24 133.21 14.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.451 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -105.9 144.56 32.45 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.664 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.574 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -117.08 -50.47 0.04 OUTLIER Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.163 -179.777 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.574 ' HD2' ' H ' ' A' ' 7' ' ' GLN . 94.4 Cg_endo -82.79 160.31 16.26 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.577 2.184 . . . . 0.0 112.223 -179.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.68 157.82 48.93 Favored Pre-proline 0 N--CA 1.464 0.255 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.197 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.98 155.96 56.76 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.637 2.225 . . . . 0.0 112.086 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.632 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -103.56 -39.07 0.2 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.739 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.632 ' CD ' ' N ' ' A' ' 11' ' ' SER . 31.6 Cg_exo -59.75 146.02 96.64 Favored 'Trans proline' 0 N--CA 1.494 1.549 0 C-N-CA 122.571 2.181 . . . . 0.0 111.813 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -68.11 107.48 2.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.516 -179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 14' ' ' ARG . 67.1 ttt-85 -112.31 26.73 10.29 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.143 0.497 . . . . 0.0 110.341 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.459 ' HG2' ' N ' ' A' ' 16' ' ' SER . 84.9 tt0 50.08 -108.18 0.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.587 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.459 ' N ' ' HG2' ' A' ' 15' ' ' GLU . 16.4 t 41.82 -139.53 0.14 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.943 0.402 . . . . 0.0 110.644 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.79 151.25 26.7 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.706 -0.957 . . . . 0.0 110.706 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -131.03 132.65 45.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.896 0.379 . . . . 0.0 110.668 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 57.5 mp0 -140.18 -1.38 1.55 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.432 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -140.62 161.12 38.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.912 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -62.85 -34.8 78.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.06 147.51 46.01 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.744 0.783 . . . . 0.0 111.222 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -63.57 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.557 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -55.57 -48.61 74.51 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.388 0.613 . . . . 0.0 109.954 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.74 -38.78 91.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.327 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -62.63 -39.03 92.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.573 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.78 -47.28 87.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.511 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.425 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.8 mm? -60.64 -41.85 95.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.048 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.491 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 49.5 t-105 -60.03 -45.23 93.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.282 0.563 . . . . 0.0 110.435 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -56.9 -43.76 81.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.153 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -60.62 -41.72 95.39 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.338 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.95 86.78 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.076 0.465 . . . . 0.0 110.046 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.491 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 76.5 mt-30 -62.6 -37.86 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -60.6 -43.9 96.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.401 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.12 -38.89 92.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.57 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.87 105.66 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.756 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -127.53 154.39 77.51 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.631 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -38.57 155.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.791 2.327 . . . . 0.0 112.144 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.37 -43.25 18.67 Favored 'Trans proline' 0 C--N 1.307 -1.639 0 C-N-CA 122.675 2.25 . . . . 0.0 112.403 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 76.9 t -63.66 -47.16 92.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.472 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -64.08 -41.75 97.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.3 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.434 ' C ' ' CD2' ' A' ' 42' ' ' LEU . 8.5 tt -61.93 -43.47 98.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.33 -41.54 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.234 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.51 -44.66 74.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.1 tp -62.73 -49.2 75.98 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.961 0.41 . . . . 0.0 110.462 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -59.81 -42.06 92.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.47 -38.93 93.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.606 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -60.34 -52.42 65.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.096 0.474 . . . . 0.0 110.455 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.01 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.253 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.09 -45.73 83.14 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.286 0.565 . . . . 0.0 110.187 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.38 -42.78 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.661 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 tp60 -52.97 -41.83 64.95 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -63.43 -40.74 97.98 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -61.51 -43.58 98.61 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.467 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -60.54 -42.23 96.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.539 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.56 -47.59 79.14 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.323 0.583 . . . . 0.0 109.889 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.54 -39.74 88.99 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.34 0.59 . . . . 0.0 109.811 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.72 87.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.612 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 68.7 t90 -57.21 -39.92 76.42 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -58.42 -46.69 85.98 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.24 -43.52 96.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.308 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -62.19 -40.41 95.97 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.015 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -58.5 -43.62 89.14 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.1 mt -60.96 -40.47 93.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.775 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 57.3 t0 -64.84 -35.49 81.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.26 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.1 33.33 7.35 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.181 -0.767 . . . . 0.0 111.181 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.2 mt -91.86 -40.37 11.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.913 0.387 . . . . 0.0 110.738 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -88.11 117.0 26.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.549 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -125.74 -37.82 2.28 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.515 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -67.09 -34.0 76.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.735 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.27 12.61 62.99 Favored Glycine 0 CA--C 1.528 0.849 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.55 -37.62 88.03 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.439 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -60.42 -47.11 87.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.067 0.461 . . . . 0.0 110.251 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -59.81 -43.5 94.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.363 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.69 -37.95 86.01 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.522 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.05 -41.69 99.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.89 -43.73 95.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.29 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.401 HD11 HG21 ' A' ' 78' ' ' ILE . 96.6 mt -64.22 -44.5 97.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.076 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 44.9 ttm180 -59.09 -42.45 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.063 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -62.72 -40.46 97.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.556 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.423 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.41 -48.45 80.61 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.89 -179.574 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -64.9 -38.88 92.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.659 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 61.4 t -62.52 -46.4 96.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 94.1 mt -60.49 -48.2 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.066 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.01 -40.86 95.54 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.068 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.37 -47.35 85.76 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.805 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.14 -47.58 82.14 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.116 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -66.15 -27.22 67.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.448 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 68.27 24.98 74.83 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 97.2 mt -103.45 16.06 27.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.831 0.348 . . . . 0.0 110.827 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.559 ' OD1' ' N ' ' A' ' 92' ' ' GLY . 41.6 p-10 -60.95 -40.93 95.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.606 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.559 ' N ' ' OD1' ' A' ' 91' ' ' ASP . . . 114.88 51.95 0.44 Allowed Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 53.8 tttm -144.99 92.55 2.28 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.778 0.323 . . . . 0.0 110.295 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -92.96 -23.82 18.59 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.651 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 58.84 49.54 9.74 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.815 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.675 ' O ' ' N ' ' A' ' 98' ' ' GLN . . . 64.99 -85.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.46 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 44.17 -80.66 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.606 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.675 ' N ' ' O ' ' A' ' 96' ' ' ALA . 17.2 tt0 54.25 82.04 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.798 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 5.3 m -127.78 129.9 70.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.272 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 54.1 m -111.57 114.07 26.9 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.64 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.7 t -63.59 -45.59 89.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.731 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -97.27 76.71 2.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.397 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.2 p -72.66 151.62 42.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.714 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 37.3 tp -122.27 128.58 51.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.082 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 42.3 t -131.16 150.16 52.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.498 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -130.69 38.19 1.99 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.413 ' O ' ' O ' ' A' ' 108' ' ' GLN . 0.0 OUTLIER -62.43 -44.12 97.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.792 0.329 . . . . 0.0 110.331 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.413 ' O ' ' O ' ' A' ' 107' ' ' THR . 99.0 mm-40 49.95 99.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.721 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -138.51 -22.94 0.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.553 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -62.84 -42.34 99.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.624 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 110.87 -55.09 0.52 Allowed Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.651 ' N ' ' CD2' ' A' ' 112' ' ' LEU . 0.9 OUTLIER -107.85 129.16 55.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.978 0.418 . . . . 0.0 110.447 -179.471 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -85.72 -65.03 1.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.862 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -93.71 152.35 40.68 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.47 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.47 -18.69 43.56 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.707 2.271 . . . . 0.0 111.909 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -63.82 -43.7 95.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.844 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 7.2 mp -74.33 -28.07 60.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.612 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.617 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.5 mt-10 -60.45 -32.65 71.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.642 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.4 mtmt -62.09 -45.91 91.43 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.905 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 47.6 mt -69.02 -46.59 67.58 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.459 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 8.4 t-105 -62.95 -44.47 95.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.542 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.617 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -69.47 -38.94 77.95 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.164 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.521 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.0 mptt -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.173 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.26 -45.57 66.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.791 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.405 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 65.3 tttm -48.25 -46.08 35.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.136 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 18.2 m -109.65 -60.2 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.643 -0.423 . . . . 0.0 112.005 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.64 -11.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.748 -178.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 0.432 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -134.13 -3.74 3.09 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.417 ' C ' ' H ' ' A' ' 131' ' ' SER . 67.4 mttm 56.91 12.75 1.27 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.265 0.555 . . . . 0.0 109.756 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.432 ' CD1' ' O ' ' A' ' 128' ' ' GLY . 6.0 m-30 -68.86 50.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.669 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.417 ' H ' ' C ' ' A' ' 129' ' ' LYS . 5.6 p -96.15 118.15 32.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.731 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 119.93 -97.97 0.69 Allowed Glycine 0 CA--C 1.53 0.979 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.492 178.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -78.85 -43.57 24.81 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.268 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.523 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.0 mp0 -60.67 -47.39 86.48 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.555 -0.458 . . . . 0.0 109.851 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.0 mt -62.87 -41.62 99.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.018 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.39 -40.57 94.83 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.999 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.6 -42.27 99.47 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.077 0.465 . . . . 0.0 110.173 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.59 -43.97 93.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.426 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -67.06 -37.7 84.48 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 144' ' ' HIS . 52.6 mtp180 -53.32 -43.93 68.01 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -71.5 -40.85 69.92 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.669 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.426 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.9 m-85 -59.01 -57.91 10.99 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.568 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 44.3 mt -60.72 -39.06 87.22 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.299 -0.561 . . . . 0.0 110.254 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.44 ' CD2' ' O ' ' A' ' 140' ' ' ARG . 4.0 m170 -51.32 -48.05 62.49 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -63.27 -39.86 95.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.664 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt -61.04 -41.56 96.81 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.318 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -67.68 -53.11 30.36 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 120.77 0.319 . . . . 0.0 111.577 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -61.3 -44.04 97.87 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.808 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.4 t -62.08 -43.86 98.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.747 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.682 ' O ' ' OD1' ' A' ' 153' ' ' ASN . 2.3 m170 -60.14 -41.59 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.56 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -64.79 -37.82 88.9 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.514 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -68.39 -50.67 51.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.131 0.491 . . . . 0.0 111.141 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . 0.804 ' OD1' ' N ' ' A' ' 154' ' ' VAL . 56.5 p30 -72.45 -38.43 68.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.865 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.804 ' N ' ' OD1' ' A' ' 153' ' ' ASN . 40.1 t -61.02 -46.45 96.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.21 -43.19 95.79 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.401 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.534 ' O ' ' OG ' ' A' ' 160' ' ' SER . 20.1 mt -62.37 -43.86 97.83 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.609 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.3 -31.54 71.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.105 0.479 . . . . 0.0 110.185 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 66.6 m -63.75 -50.89 67.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.884 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.42 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 1.7 pp -77.11 -31.06 55.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.663 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 74.4 m -60.3 -42.15 94.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.686 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.45 ' C ' ' H ' ' A' ' 163' ' ' GLU . 97.8 mtt180 -61.97 -44.26 97.11 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.947 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.407 ' CG2' ' O ' ' A' ' 162' ' ' THR . 35.6 m -77.91 36.36 0.22 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.754 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.45 ' H ' ' C ' ' A' ' 161' ' ' ARG . 80.8 tt0 -141.07 -31.24 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.943 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.443 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 69.1 tt0 -102.7 24.39 10.62 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.398 0.618 . . . . 0.0 109.935 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.455 ' CG2' ' O ' ' A' ' 165' ' ' ILE . 8.2 tp -56.0 104.95 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.731 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 54.2 m170 45.98 30.51 0.92 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.13 0.49 . . . . 0.0 110.111 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -81.86 89.0 6.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.479 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -101.49 14.14 32.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.285 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 11.8 t -93.58 133.37 34.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.62 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 17.9 tt -119.13 137.97 51.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.458 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' SER . . . . . 0.516 ' O ' ' N ' ' A' ' 173' ' ' SER . 6.9 t -136.5 85.9 24.65 Favored Pre-proline 0 C--O 1.232 0.154 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.504 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -38.88 87.38 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.456 0 C-N-CA 122.692 2.262 . . . . 0.0 112.038 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.516 ' N ' ' O ' ' A' ' 171' ' ' SER . 8.0 t -114.48 133.96 55.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.473 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -58.78 -10.12 2.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.974 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.538 ' O ' ' CG1' ' A' ' 178' ' ' ILE . 0.5 OUTLIER -169.47 52.94 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.732 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.639 ' O ' ' N ' ' A' ' 178' ' ' ILE . 2.7 m 59.44 144.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.834 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -60.39 64.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.567 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.639 ' N ' ' O ' ' A' ' 176' ' ' SER . 3.7 pt -128.32 147.17 32.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.8 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -63.97 -41.4 97.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.311 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.425 ' O ' ' OG ' ' A' ' 181' ' ' SER . . . 88.13 89.12 1.12 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.539 ' C ' ' NE2' ' A' ' 184' ' ' HIS . 24.7 m -166.74 0.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.658 0.266 . . . . 0.0 110.735 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 9.2 t -146.3 -24.52 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.713 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.426 ' N ' ' CD2' ' A' ' 183' ' ' LEU . 4.2 mm? -63.42 -40.02 96.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.976 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.539 ' NE2' ' C ' ' A' ' 181' ' ' SER . 9.1 p80 -49.79 -41.22 43.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.355 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 11.2 t -61.86 -45.09 95.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.185 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -61.16 -45.12 95.93 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.071 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 31.6 m-70 -64.27 -35.41 80.75 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.028 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 55.2 m -62.32 -43.93 97.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.985 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -62.71 -41.08 98.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.7 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.488 ' N ' HD13 ' A' ' 190' ' ' LEU . 9.5 mp -62.12 -42.92 99.71 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.623 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.525 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 23.7 mmtp -67.51 -39.54 85.14 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 83.0 tt0 -67.79 -47.68 68.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.997 0.427 . . . . 0.0 111.66 -179.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.472 ' HZ1' ' HG ' ' A' ' 190' ' ' LEU . 1.0 OUTLIER -73.13 -43.12 62.08 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.415 -179.315 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.527 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.94 -42.09 77.21 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.053 -179.648 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.563 ' CZ ' HE22 ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.51 -39.25 93.43 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.436 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 49.9 m -60.46 -43.76 96.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.41 -43.23 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.9 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -62.3 -41.53 98.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.847 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.563 HE22 ' CZ ' ' A' ' 195' ' ' ARG . 84.1 mt-30 -63.6 -38.52 91.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.579 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.87 -48.83 84.13 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.8 mt -62.84 -39.71 95.22 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.129 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.53 ' HB3' HH12 ' A' ' 206' ' ' ARG . 48.8 m-20 -62.31 -37.45 85.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.482 0.658 . . . . 0.0 109.419 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.409 ' C ' ' HD2' ' A' ' 203' ' ' ARG . 4.1 tmm_? -61.66 -41.96 98.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.145 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.5 mt -61.14 -39.62 90.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.434 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -60.95 -43.72 98.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.746 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.68 ' O ' ' N ' ' A' ' 210' ' ' GLN . 84.7 mtt85 -64.54 -39.8 94.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.234 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.604 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.1 t -63.62 -45.58 97.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.077 0.465 . . . . 0.0 110.236 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.06 -29.55 64.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.72 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -96.85 -16.75 20.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.274 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.68 ' N ' ' O ' ' A' ' 206' ' ' ARG . 18.8 mm100 -127.66 -37.89 1.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.781 0.324 . . . . 0.0 110.697 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.604 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -66.57 3.16 3.82 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.47 ' H ' ' C ' ' A' ' 210' ' ' GLN . 2.5 m-85 -91.68 168.74 11.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.882 0.372 . . . . 0.0 110.502 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 7.0 m -72.01 -5.62 36.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.429 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 35.1 p -68.67 142.33 55.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.592 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -138.78 151.96 47.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.928 0.394 . . . . 0.0 110.301 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . 64.93 121.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.862 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -146.84 15.85 1.22 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.577 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -62.12 -141.06 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 121.049 0.452 . . . . 0.0 110.125 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -57.44 -43.54 84.01 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 119.931 -0.707 . . . . 0.0 109.123 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.564 ' O ' ' N ' ' A' ' 222' ' ' ARG . 18.2 tt0 -170.21 131.39 0.95 Allowed Pre-proline 0 CA--C 1.533 0.305 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.778 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.419 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 76.5 Cg_exo -47.17 79.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.668 2.245 . . . . 0.0 112.233 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.564 ' N ' ' O ' ' A' ' 220' ' ' GLU . 0.7 OUTLIER 165.38 -46.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.606 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.687 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 2.1 p -61.48 -84.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.42 0.629 . . . . 0.0 111.228 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.687 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 1.1 mp -52.97 -26.66 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.062 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -63.15 -46.45 87.12 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.326 0.584 . . . . 0.0 109.864 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 17.5 mt -61.76 -40.75 96.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.362 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . 0.437 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 40.8 m0 -61.24 -37.1 81.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.957 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . 0.498 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 66.4 t0 -63.48 -37.17 86.28 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' A' ' 230' ' ' ALA . 95.7 mt -64.53 -42.24 95.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.442 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.587 ' O ' ' N ' ' A' ' 233' ' ' ALA . . . -29.97 -70.25 0.06 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.298 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 4.1 pt20 -38.0 -47.82 1.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.444 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.443 ' N ' ' O ' ' A' ' 229' ' ' LEU . 6.2 m -86.17 31.88 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.357 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . 0.587 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -150.51 111.06 4.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . 0.668 ' O ' ' HB2' ' A' ' 235' ' ' LEU . 65.0 t30 48.12 -142.6 0.48 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.228 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . 0.668 ' HB2' ' O ' ' A' ' 234' ' ' ASN . 60.6 mt 85.93 148.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.926 0.766 . . . . 0.0 110.746 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 236' ' ' THR . . . . . 0.571 ' H ' ' CD ' ' A' ' 239' ' ' GLU . 0.9 OUTLIER -100.23 -119.86 0.16 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.511 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . 0.568 ' N ' ' OE1' ' A' ' 239' ' ' GLU . 32.6 p-10 -122.06 -62.49 1.39 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.864 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.67 -42.16 99.48 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.185 0.517 . . . . 0.0 110.794 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . 0.725 ' HB2' ' ND1' ' A' ' 320' ' ' HIS . 3.2 pm0 -58.5 -29.19 66.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.691 179.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . 0.532 ' N ' ' CD ' ' A' ' 239' ' ' GLU . 0.3 OUTLIER -67.17 -57.89 5.9 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.002 -179.153 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -55.37 -49.45 72.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.515 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.41 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.059 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 1.5 t80 -62.12 -44.86 95.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.238 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 59.4 ttm-85 -57.9 -48.54 79.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.972 0.415 . . . . 0.0 110.355 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.5 -39.27 85.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.628 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -58.9 -55.02 40.57 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.331 0.586 . . . . 0.0 110.344 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.443 ' CD2' ' N ' ' A' ' 247' ' ' LEU . 3.9 mm? -63.91 -34.31 77.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.688 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.7 tttt -57.73 -43.15 85.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 110.265 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -68.57 -43.59 76.25 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.351 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.6 -47.66 82.8 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.504 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.688 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.5 pp20? -60.82 -38.0 83.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.079 0.466 . . . . 0.0 109.756 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.01 -39.07 89.96 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.495 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -63.17 -47.43 82.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.487 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.433 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 11.3 tt -63.36 -34.83 69.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.072 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.77 -45.44 89.76 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.179 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.02 -43.35 99.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.139 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -43.44 79.41 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.015 0.436 . . . . 0.0 109.976 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -61.02 -41.29 96.27 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.311 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -58.93 -46.28 88.36 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.107 0.479 . . . . 0.0 110.355 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -61.18 -40.84 95.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.119 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.656 HE21 ' CG2' ' A' ' 297' ' ' THR . 88.2 mm-40 -56.47 -44.15 80.29 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.011 0.434 . . . . 0.0 110.089 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.3 -45.32 94.97 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.059 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -60.06 -38.32 82.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.11 -42.39 99.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.373 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -61.17 -47.55 85.67 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.058 0.456 . . . . 0.0 110.476 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.239 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.68 88.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -60.53 -49.21 78.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.357 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -62.7 -44.87 95.13 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.53 -39.8 92.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 4.2 tt -60.72 -45.43 94.26 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.448 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -61.78 -40.23 94.44 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.55 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 12.1 m80 -71.34 -41.39 69.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.914 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -67.97 -41.64 82.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.985 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -56.94 -17.62 10.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.57 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 29.5 m -61.16 -43.99 98.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.628 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 2.1 p -66.87 -35.9 75.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.507 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 76.69 37.65 34.0 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . 0.404 ' C ' ' OD1' ' A' ' 279' ' ' ASP . 59.9 t0 -59.79 -44.0 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.845 0.355 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 81.87 -4.12 76.51 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -94.04 -69.9 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.905 0.383 . . . . 0.0 110.375 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -70.77 -20.84 62.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.773 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 58.6 t -62.04 -47.83 91.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.587 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 46.5 t -63.94 -44.53 92.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.047 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.8 -42.31 99.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.649 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 286' ' ' SER . . . . . 0.402 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 39.9 t -62.32 -46.72 87.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.628 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -64.58 -39.55 93.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.949 0.404 . . . . 0.0 110.742 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -58.66 -58.11 10.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.153 0.502 . . . . 0.0 110.167 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -64.47 -31.98 73.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.901 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 286' ' ' SER . 58.1 t-80 -54.49 -51.34 65.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.865 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.32 82.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.462 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 15.6 tp -62.04 -49.63 75.24 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.779 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . 0.415 ' N ' HD12 ' A' ' 293' ' ' LEU . 9.9 mp -62.85 -41.67 99.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.941 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.465 ' O ' ' OG1' ' A' ' 297' ' ' THR . 68.8 mm-40 -61.09 -38.06 84.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.078 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.9 -45.22 96.13 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 16.8 tpp85 -61.21 -43.46 98.85 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.693 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.656 ' CG2' HE21 ' A' ' 261' ' ' GLN . 31.5 p -60.22 -43.5 95.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.433 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -63.89 -45.12 90.8 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.449 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.39 -40.78 97.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.267 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -44.08 97.64 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.186 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.8 -41.28 97.55 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -61.35 -46.03 91.94 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.157 0.503 . . . . 0.0 110.719 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.7 m -60.8 -44.38 96.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.56 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -61.08 -43.16 95.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.346 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.22 -49.55 76.66 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.111 0.481 . . . . 0.0 110.803 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -62.13 -44.37 96.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.458 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -66.82 -31.09 71.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.151 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.07 -47.9 83.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.064 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.49 -44.14 71.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.808 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . 0.488 ' O ' ' NH1' ' A' ' 319' ' ' ARG . 95.4 m-20 -59.68 -51.93 67.67 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.013 0.435 . . . . 0.0 111.089 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . 0.489 ' O ' HG13 ' A' ' 315' ' ' ILE . 36.4 mt -62.57 -48.21 80.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.783 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 8.0 m -69.52 -12.89 62.02 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.693 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -79.57 -64.43 1.9 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.442 ' HB2' HH11 ' A' ' 319' ' ' ARG . 89.5 mmt-85 -68.76 -37.6 79.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.01 0.405 . . . . 0.0 110.972 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . 0.553 HD13 ' O ' ' A' ' 318' ' ' ALA . 1.2 mm -57.5 -19.88 12.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.748 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.467 ' C ' ' O ' ' A' ' 315' ' ' ILE . 82.0 p -36.67 -33.8 0.06 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 315' ' ' ILE . 0.1 OUTLIER -114.22 -36.56 4.66 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.924 177.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.71 ' HB3' ' NE2' ' A' ' 320' ' ' HIS . . . -176.42 -71.4 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.777 ' O ' ' ND1' ' A' ' 320' ' ' HIS . 40.0 ttt85 72.3 -76.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.221 0.534 . . . . 0.0 111.702 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . 0.777 ' ND1' ' O ' ' A' ' 319' ' ' ARG . 0.0 OUTLIER 53.62 -49.55 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.815 -179.745 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.75 ' N ' ' O ' ' A' ' 319' ' ' ARG . 9.6 t-20 144.49 -12.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.53 ' H ' ' HD1' ' A' ' 320' ' ' HIS . 6.9 tm-20 -68.11 -34.95 77.33 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.358 179.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.436 ' CD2' ' HA ' ' A' ' 319' ' ' ARG . 9.1 mp . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.058 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 4' ' ' GLU . 87.0 p -157.18 159.08 37.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.464 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.466 ' C ' ' O ' ' A' ' 2' ' ' SER . 88.8 mtm180 33.34 32.3 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.516 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.543 ' N ' ' O ' ' A' ' 2' ' ' SER . 16.8 pt-20 -65.88 -39.95 91.13 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.77 0.319 . . . . 0.0 110.521 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.9 tttm -163.51 153.89 15.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.469 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -67.79 131.13 44.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.204 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -138.44 130.48 15.86 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.499 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.51 157.71 48.66 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.395 2.063 . . . . 0.0 112.391 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.1 tptt 55.41 76.22 0.53 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.791 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.48 157.62 52.58 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.439 2.092 . . . . 0.0 112.167 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.9 t -161.04 74.44 2.61 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.713 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -61.2 145.01 99.13 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.858 2.372 . . . . 0.0 112.164 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -136.4 117.12 14.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.503 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.501 ' O ' ' N ' ' A' ' 16' ' ' SER . 34.4 ptt-85 -163.44 -158.69 0.48 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.644 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.09 53.3 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.841 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.501 ' N ' ' O ' ' A' ' 14' ' ' ARG . 17.4 m -75.06 148.71 39.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.194 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -132.6 64.56 0.6 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.086 -0.805 . . . . 0.0 111.086 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -125.07 112.98 17.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.847 0.356 . . . . 0.0 110.543 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 57.0 mp0 -99.42 -8.91 24.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.48 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -136.09 165.28 26.08 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.966 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.491 HH21 ' CG ' ' A' ' 53' ' ' GLU . 80.4 mtm180 -64.19 -36.61 84.62 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.505 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 30.6 mtp -125.0 147.88 48.73 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.648 0.737 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.687 ' H ' ' CD ' ' A' ' 23' ' ' GLU . 2.0 pm0 -59.15 -32.03 69.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.86 -50.13 73.39 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.31 0.576 . . . . 0.0 110.588 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.33 -38.74 87.99 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.286 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.414 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 55.1 t-20 -63.45 -37.6 87.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.333 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.36 -48.25 82.55 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.297 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.413 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 4.1 mm? -61.06 -42.43 98.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.115 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.567 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 54.6 t-105 -61.81 -43.53 98.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -57.55 -44.25 85.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.207 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -61.42 -41.29 96.93 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.107 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.11 87.2 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.147 0.498 . . . . 0.0 110.129 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.567 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -63.43 -37.68 88.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.075 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -59.91 -44.37 94.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.317 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.36 -39.65 94.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.381 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.46 104.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.798 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.7 mt -121.95 154.3 61.01 Favored Pre-proline 0 C--O 1.233 0.214 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.616 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -40.53 154.11 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.513 2.142 . . . . 0.0 112.377 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.5 -43.67 49.15 Favored 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.521 2.147 . . . . 0.0 112.62 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -48.34 88.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.812 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -66.23 -38.54 88.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.564 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.9 tt -63.63 -43.56 96.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.66 -47.87 76.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.757 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -66.71 -41.81 87.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.614 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.4 tp -62.54 -48.57 78.92 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.541 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -60.25 -41.63 93.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.289 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.4 90.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.744 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.409 ' OD1' ' C ' ' A' ' 48' ' ' ASP . 61.3 t0 -60.4 -53.28 59.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.394 . . . . 0.0 110.688 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.86 -39.68 95.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.206 0.527 . . . . 0.0 110.487 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -56.8 -46.79 81.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.133 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.409 HG22 HD12 ' A' ' 51' ' ' ILE . 96.7 mt -63.09 -42.49 96.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.679 179.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -49.57 -45.58 47.9 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.491 ' CG ' HH21 ' A' ' 21' ' ' ARG . 42.1 tp10 -66.99 -36.47 82.24 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.359 -0.537 . . . . 0.0 109.599 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.59 -46.41 89.96 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -64.24 -40.08 95.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.503 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.6 -49.75 74.01 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.983 0.42 . . . . 0.0 110.259 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.82 -42.34 97.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.861 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.78 96.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -57.09 -42.66 81.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.202 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.59 -45.25 94.68 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.72 -45.43 81.89 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.256 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mp -62.36 -42.29 99.28 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.996 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -55.83 -43.99 77.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 41.1 tp -63.14 -39.49 94.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.757 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -62.64 -19.5 63.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.017 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.73 21.98 10.71 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 83.4 mt -106.44 -169.38 1.56 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.077 0.465 . . . . 0.0 110.152 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.2 t70 54.21 97.92 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.568 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -125.37 -35.85 2.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.702 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.15 -36.28 83.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.648 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 85.73 12.26 72.36 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -69.29 -36.95 77.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.737 0.303 . . . . 0.0 110.326 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -59.99 -59.58 5.19 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.961 0.41 . . . . 0.0 110.553 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -57.19 -40.03 76.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.129 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.6 -41.31 90.06 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.257 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -63.15 -42.28 99.42 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.4 mt -63.63 -43.68 96.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.161 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.57 -45.48 97.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.312 0.577 . . . . 0.0 110.06 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -59.46 -43.1 93.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.135 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.421 ' O ' HG13 ' A' ' 84' ' ' ILE . 96.0 m-20 -62.09 -39.68 93.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.374 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.409 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.72 -48.92 79.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.312 0.577 . . . . 0.0 109.874 -179.503 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -64.54 -38.74 92.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 70.4 t -63.5 -46.19 95.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.649 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.35 -49.49 83.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.313 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.62 -39.89 88.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.868 0.366 . . . . 0.0 110.788 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -58.36 -50.26 74.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.787 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.92 -43.87 97.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.806 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -62.91 -27.06 69.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.311 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.35 22.64 78.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.8 mt -100.3 16.25 24.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.93 0.395 . . . . 0.0 110.612 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -80.06 -83.43 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -77.76 171.39 55.15 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.206 -0.757 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -141.14 131.51 25.15 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.723 0.297 . . . . 0.0 110.571 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.581 ' O ' ' N ' ' A' ' 96' ' ' ALA . 12.5 tttt 50.16 94.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.864 0.364 . . . . 0.0 110.293 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.7 t70 45.86 -85.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.591 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 94' ' ' LYS . . . 175.13 170.3 0.29 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.804 0.335 . . . . 0.0 110.557 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.39 149.77 28.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.635 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -160.88 -24.28 0.06 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.409 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.5 t -86.41 100.48 9.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.859 0.361 . . . . 0.0 110.4 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 10.7 t -154.49 149.22 26.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.469 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.1 t -118.31 108.5 15.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.562 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.415 ' O ' ' O ' ' A' ' 103' ' ' SER . 85.9 m-20 -65.23 -41.26 94.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.811 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 102' ' ' ASN . 4.0 m 50.74 102.4 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.799 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.2 mp 58.17 -172.39 0.1 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.675 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 52.1 m -60.0 -43.34 95.25 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.925 0.393 . . . . 0.0 110.814 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 63.44 29.99 76.24 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.432 ' H ' ' HG1' ' A' ' 107' ' ' THR . 11.9 p -72.16 136.31 46.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.811 0.338 . . . . 0.0 110.755 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -137.43 125.76 23.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.336 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -98.06 137.48 36.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.685 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -65.68 -40.55 92.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.556 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 179.76 -85.83 0.07 OUTLIER Glycine 0 N--CA 1.463 0.438 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 33.8 tp -141.31 130.81 23.87 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.618 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.427 ' O ' ' CG ' ' A' ' 114' ' ' ASP . 91.7 m-20 -80.76 61.85 4.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.427 ' CG ' ' O ' ' A' ' 113' ' ' ASP . 13.6 m-20 -163.77 86.97 1.22 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.487 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -49.55 -33.7 31.53 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.63 2.22 . . . . 0.0 112.192 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -64.35 -41.38 96.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.942 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 80.8 mt -81.74 -27.07 34.03 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.151 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.5 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 94.9 mt-10 -54.56 -28.68 47.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.476 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.553 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.8 mttt -62.37 -48.14 81.1 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.795 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.53 -44.41 78.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.439 . . . . 0.0 112.013 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.42 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 10.3 t-105 -56.54 -53.67 54.83 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.795 -178.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.5 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 8.2 m-70 -67.6 -31.8 72.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.49 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.589 ' O ' ' OG ' ' A' ' 127' ' ' SER . 13.8 tptt -57.33 -50.68 72.19 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.052 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.09 -46.84 64.04 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.806 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -50.6 -48.08 57.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.004 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.2 m -85.05 -39.35 18.1 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.603 ' O ' ' CE2' ' A' ' 212' ' ' TYR . 17.0 m -45.75 -30.86 1.76 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.096 -178.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -152.67 -90.17 0.08 OUTLIER Glycine 0 N--CA 1.464 0.541 0 C-N-CA 119.993 -1.099 . . . . 0.0 111.184 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.78 23.3 0.06 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.432 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -67.5 50.48 0.05 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.401 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.43 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.3 m -104.3 118.48 36.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.013 0.435 . . . . 0.0 111.812 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 111.94 -98.04 0.97 Allowed Glycine 0 CA--C 1.53 1.008 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.531 178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.532 ' O ' ' OD2' ' A' ' 136' ' ' ASP . 12.8 pt-20 -73.78 -42.16 61.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.213 0.53 . . . . 0.0 111.149 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.454 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.7 mp0 -59.24 -48.29 82.18 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.258 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.08 -40.48 95.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.127 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.532 ' OD2' ' O ' ' A' ' 133' ' ' GLU . 0.0 OUTLIER -62.12 -39.31 92.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.075 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -63.1 -43.94 97.08 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 110.02 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.8 mm? -59.95 -42.21 93.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -33.54 76.14 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.69 177.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.589 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 82.0 mmt-85 -58.67 -41.48 86.25 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.67 -40.55 76.34 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.568 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -58.93 -58.45 8.58 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.137 0.494 . . . . 0.0 110.481 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.47 -36.97 77.01 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.049 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.589 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 49.0 m170 -54.17 -42.4 69.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -65.98 -36.81 84.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.451 ' O ' HG13 ' A' ' 149' ' ' VAL . 70.2 mmtt -59.85 -45.89 90.99 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.47 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.422 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.7 pt-20 -71.42 -47.89 53.05 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.412 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.422 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 49.0 mtmt -63.2 -46.64 86.08 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.178 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.451 HG13 ' O ' ' A' ' 146' ' ' LYS . 6.5 p -62.86 -36.5 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.224 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.563 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -65.33 -40.6 93.88 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.402 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 155' ' ' LEU . 79.2 mm-40 -64.27 -39.87 94.82 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.534 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.437 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 22.1 m-85 -62.54 -49.13 76.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . 0.541 ' OD1' ' HA ' ' A' ' 150' ' ' HIS . 0.9 OUTLIER -74.57 -42.57 58.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.003 0.43 . . . . 0.0 111.004 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.563 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 70.8 t -61.61 -45.65 98.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.892 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.413 ' CG ' ' O ' ' A' ' 151' ' ' GLU . 77.9 mt -64.26 -42.57 96.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.197 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 18.3 mt -62.68 -43.54 98.54 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.671 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . 0.405 ' O ' ' OG ' ' A' ' 160' ' ' SER . 96.6 mt-10 -68.36 -27.61 66.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.034 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 57.9 m -69.68 -48.77 58.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.172 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 pp -78.21 -24.56 47.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.661 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.458 ' HG ' ' N ' ' A' ' 161' ' ' ARG . 85.2 p -58.02 -38.57 76.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.384 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.458 ' N ' ' HG ' ' A' ' 160' ' ' SER . 99.5 mtt180 -65.75 -39.74 91.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.755 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 3.2 m -81.3 36.57 0.42 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.696 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -123.44 -40.98 2.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.946 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 76.3 tt0 -85.4 23.46 1.32 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.356 0.598 . . . . 0.0 110.07 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.413 ' CG2' ' O ' ' A' ' 165' ' ' ILE . 7.0 tp -56.81 92.24 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.6 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 m170 50.42 25.03 1.75 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.129 0.49 . . . . 0.0 109.974 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.19 91.98 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.593 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.45 ' H ' ' ND2' ' A' ' 168' ' ' ASN . 0.5 OUTLIER -114.13 21.08 15.1 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.576 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 59.8 t -116.95 127.76 74.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.843 0.354 . . . . 0.0 110.448 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.6 tt -141.78 132.33 25.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.598 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.91 160.08 41.47 Favored Pre-proline 0 N--CA 1.456 -0.16 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.275 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.608 ' O ' ' O ' ' A' ' 173' ' ' SER . 62.8 Cg_exo -47.13 -54.46 4.99 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.498 2.132 . . . . 0.0 112.31 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.608 ' O ' ' O ' ' A' ' 172' ' ' PRO . 1.0 OUTLIER 44.45 111.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.991 0.424 . . . . 0.0 110.627 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -54.12 -41.02 67.87 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 177' ' ' ASP . 1.8 tt -153.56 104.45 2.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 14.8 t 50.15 -85.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.769 0.319 . . . . 0.0 110.407 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.561 ' N ' ' O ' ' A' ' 175' ' ' LEU . 45.9 p-10 -162.76 24.46 0.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.916 0.389 . . . . 0.0 110.85 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.461 HD13 ' O ' ' A' ' 175' ' ' LEU . 1.1 pp -146.64 159.51 10.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.923 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -88.58 46.83 1.42 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.398 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.429 ' H ' HD12 ' A' ' 178' ' ' ILE . . . 78.89 12.09 84.53 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 12.4 t -62.63 -44.25 96.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.789 0.328 . . . . 0.0 110.683 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.645 ' C ' ' H ' ' A' ' 184' ' ' HIS . 2.1 t -141.24 -144.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.611 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.53 ' H ' ' CG1' ' A' ' 182' ' ' VAL . 5.3 tp 63.91 -36.31 0.17 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.154 0.502 . . . . 0.0 110.828 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.763 ' CD2' ' H ' ' A' ' 185' ' ' SER . 0.6 OUTLIER -56.11 -41.0 74.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.715 -179.677 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.763 ' H ' ' CD2' ' A' ' 184' ' ' HIS . 10.7 t -60.64 -45.16 95.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.456 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.74 -45.49 93.72 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.84 0.353 . . . . 0.0 110.749 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 31.4 m-70 -66.79 -34.81 78.64 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.243 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' THR . . . . . 0.436 ' CG2' ' OE2' ' A' ' 192' ' ' GLU . 54.6 m -61.95 -43.87 97.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.169 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -65.12 -40.52 94.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.114 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.584 ' CD2' ' HZ1' ' A' ' 193' ' ' LYS . 3.6 mt -62.15 -46.25 89.82 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.882 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 66.2 mttm -71.73 -40.71 69.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.442 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.466 ' O ' ' OG ' ' A' ' 196' ' ' SER . 94.1 mt-10 -68.51 -43.76 76.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.827 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.584 ' HZ1' ' CD2' ' A' ' 190' ' ' LEU . 22.6 pttt -72.31 -43.81 63.64 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.215 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.572 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.02 -42.9 72.38 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.777 -179.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.515 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -66.03 -37.05 84.9 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 192' ' ' GLU . 57.7 m -59.37 -42.55 91.91 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.41 ' OD1' ' C ' ' A' ' 198' ' ' ASN . 32.8 t-20 -62.54 -42.53 99.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.768 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -64.93 -34.15 77.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.381 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.05 -46.79 92.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.281 -1.127 . . . . 0.0 110.281 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 30.2 mt -62.69 -42.26 99.54 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.376 -0.53 . . . . 0.0 109.946 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -62.88 -36.66 84.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.468 ' HD2' ' O ' ' A' ' 203' ' ' ARG . 15.4 tpt180 -64.23 -41.56 96.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.821 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.25 -38.52 80.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -65.58 -42.15 92.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.623 ' O ' ' N ' ' A' ' 210' ' ' GLN . 79.1 mtt85 -65.74 -36.74 84.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.087 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.651 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.33 -45.99 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.04 0.448 . . . . 0.0 110.127 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 90.0 p -70.25 -27.25 64.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.539 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -98.06 -14.22 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.623 ' N ' ' O ' ' A' ' 206' ' ' ARG . 53.3 tt0 -137.17 -36.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.775 0.322 . . . . 0.0 110.745 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.651 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -66.88 33.84 0.18 Allowed Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.623 ' H ' ' C ' ' A' ' 210' ' ' GLN . 23.9 t80 -61.19 -44.53 97.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.096 0.474 . . . . 0.0 110.03 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 176.95 -71.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.731 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 66.0 p 47.94 19.39 0.18 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.925 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 45.3 -165.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.656 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . 0.495 ' O ' ' CB ' ' A' ' 217' ' ' GLU . . . -101.61 -69.14 0.79 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.977 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.525 ' O ' ' C ' ' A' ' 218' ' ' PHE . 23.0 tp10 83.87 8.96 0.54 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.693 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.525 ' C ' ' O ' ' A' ' 217' ' ' GLU . 72.5 m-85 24.77 86.15 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.884 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -176.37 -28.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.187 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.631 ' O ' ' O ' ' A' ' 221' ' ' PRO . 3.1 tm-20 -59.19 128.91 85.99 Favored Pre-proline 0 C--N 1.329 -0.325 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.236 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.669 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 76.8 Cg_exo -47.09 -155.9 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.611 2.207 . . . . 0.0 111.772 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.669 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 83.5 mtp180 85.81 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.71 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.413 ' CG1' ' N ' ' A' ' 224' ' ' ILE . 7.5 p -61.07 -51.71 70.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.413 ' N ' ' CG1' ' A' ' 223' ' ' VAL . 0.6 OUTLIER -64.35 -32.72 58.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.332 0.586 . . . . 0.0 109.516 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -63.25 -39.35 94.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.477 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.7 mt -61.29 -40.89 95.83 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 43.6 m0 -59.61 -40.08 86.33 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.029 -0.668 . . . . 0.0 110.057 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 49.6 m-20 -63.52 -36.94 85.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.654 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.621 ' C ' ' H ' ' A' ' 231' ' ' GLN . 13.0 mt -63.85 -41.07 97.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.311 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -59.2 4.95 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.974 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.621 ' H ' ' C ' ' A' ' 229' ' ' LEU . 5.4 pt20 -64.27 -40.96 97.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.839 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 18.8 p -154.03 23.39 0.5 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.522 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -60.87 -47.63 85.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.677 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -176.9 65.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.55 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 94.1 mt -133.42 157.11 46.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.083 0.468 . . . . 0.0 110.675 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 22.0 p -78.95 171.23 15.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.49 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -64.55 -45.25 87.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.996 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.91 -45.61 92.99 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.25 0.548 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . 0.422 ' HG2' ' HA ' ' A' ' 322' ' ' GLU . 95.8 mt-10 -64.64 -33.79 76.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.696 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -42.8 99.83 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.508 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . 0.582 ' OE2' ' NH2' ' A' ' 244' ' ' ARG . 53.1 tp10 -63.73 -47.72 79.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.197 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.95 -42.75 99.47 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.359 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.587 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.1 OUTLIER -69.87 -30.27 67.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.447 179.406 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . 0.582 ' NH2' ' OE2' ' A' ' 241' ' ' GLU . 57.8 ttp180 -65.03 -58.61 5.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.089 0.471 . . . . 0.0 110.691 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -66.32 -39.38 89.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.088 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -57.74 -55.88 29.09 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.304 0.574 . . . . 0.0 110.495 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 247' ' ' LEU . 3.8 mm? -63.77 -33.2 75.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.386 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.621 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.8 tttt -58.75 -42.74 89.57 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.28 0.562 . . . . 0.0 110.272 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . 0.509 ' HD1' ' NZ ' ' A' ' 253' ' ' LYS . 6.4 m-70 -68.89 -43.67 74.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.241 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -61.27 -50.16 74.16 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.433 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.621 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.6 pp20? -60.24 -37.13 79.41 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.7 81.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.548 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . 0.509 ' NZ ' ' HD1' ' A' ' 249' ' ' HIS . 13.9 mptt -63.55 -48.64 76.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.36 -38.99 83.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.058 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -59.44 -54.7 43.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.291 0.567 . . . . 0.0 110.434 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -63.43 -40.6 97.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.915 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . 0.485 ' NE2' ' O ' ' A' ' 297' ' ' THR . 28.4 t-80 -54.28 -47.2 72.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.12 0.486 . . . . 0.0 109.967 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . 0.407 ' O ' ' HB2' ' A' ' 261' ' ' GLN . 60.4 t-20 -61.64 -41.07 96.98 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.174 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -56.34 -45.5 80.36 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 121.098 0.475 . . . . 0.0 109.947 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -63.79 -34.91 78.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.049 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 257' ' ' HIS . 26.6 mt-30 -58.57 -47.59 83.75 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -61.58 -45.87 92.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.103 0.478 . . . . 0.0 109.754 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -64.85 -33.07 75.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.006 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 47.2 tp -62.36 -43.78 98.01 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.92 0.391 . . . . 0.0 110.268 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -65.91 -46.01 79.84 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.208 0.527 . . . . 0.0 110.444 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.18 -43.63 98.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.311 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.99 86.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.135 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.69 -45.55 93.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -60.08 -48.99 79.43 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.217 0.532 . . . . 0.0 110.65 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -62.15 -39.2 91.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.56 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 275' ' ' GLU . 4.8 tt -60.49 -44.26 96.14 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.965 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 63.0 ttm-85 -60.2 -43.12 96.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.157 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -66.48 -39.84 89.0 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.651 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.35 84.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 271' ' ' LEU . 96.1 mt-10 -49.64 -19.18 0.55 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.848 0.356 . . . . 0.0 110.396 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 276' ' ' SER . . . . . 0.754 ' O ' ' N ' ' A' ' 278' ' ' GLY . 58.6 m -82.81 -75.89 0.29 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.814 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.506 ' C ' ' O ' ' A' ' 276' ' ' SER . 44.1 t 24.29 -77.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 O-C-N 123.686 0.616 . . . . 0.0 110.831 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.754 ' N ' ' O ' ' A' ' 276' ' ' SER . . . 161.17 -77.67 0.17 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.287 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -86.55 123.05 31.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.883 0.373 . . . . 0.0 110.474 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -67.64 144.1 43.24 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -174.92 -46.42 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -96.1 -6.09 39.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.723 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 67.0 t -62.22 -46.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.512 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.39 -46.19 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.071 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.38 -45.41 94.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.5 t -62.11 -42.82 99.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.635 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -63.22 -40.94 98.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.79 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -60.71 -54.31 46.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.364 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.8 mmtm -65.09 -33.81 76.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.158 179.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -57.92 -49.01 78.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.271 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -70.07 -38.22 75.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.747 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 2.7 tp -61.62 -50.24 73.37 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.254 -0.579 . . . . 0.0 110.175 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . 0.436 ' O ' ' OG1' ' A' ' 297' ' ' THR . 0.9 OUTLIER -63.55 -41.97 98.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.008 179.725 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -62.23 -42.46 99.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.19 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -60.93 -47.77 89.59 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 20.3 tpp85 -61.9 -37.34 84.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.437 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.485 ' O ' ' NE2' ' A' ' 257' ' ' HIS . 3.6 m -59.64 -52.24 66.37 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.399 0.618 . . . . 0.0 110.189 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.14 -39.26 92.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -58.23 -45.64 87.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.294 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -44.11 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.132 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -54.96 -44.29 82.62 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -62.49 -43.37 98.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.129 0.49 . . . . 0.0 110.665 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 303' ' ' THR . . . . . 0.523 HG22 ' HD1' ' A' ' 307' ' ' HIS . 17.9 m -59.08 -44.76 91.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.578 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.06 -41.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.202 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -56.52 -57.09 13.83 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-O 121.44 0.638 . . . . 0.0 111.075 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 4.7 mtpt -62.41 -39.94 94.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.723 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.523 ' HD1' HG22 ' A' ' 303' ' ' THR . 4.6 m80 -64.24 -35.7 81.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.106 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 15.4 mt -61.81 -43.93 97.86 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.397 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -67.32 -45.73 75.59 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.998 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.54 -49.67 75.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.963 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 21.9 mt -63.85 -40.63 97.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.856 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 69.4 m -57.7 -43.8 85.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.358 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.49 -43.38 86.94 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 317' ' ' ARG . 7.0 mpt_? -63.66 -45.64 89.22 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.773 0.321 . . . . 0.0 111.058 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -73.17 -23.35 19.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.126 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 38.4 t -59.18 -43.71 92.18 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 314' ' ' ARG . 10.8 tpp180 -117.02 124.59 49.67 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -115.96 101.35 8.69 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.386 -0.525 . . . . 0.0 112.116 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.418 ' C ' ' H ' ' A' ' 321' ' ' ASN . 90.4 mtm180 -78.4 160.43 27.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.582 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.19 4.21 6.01 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.449 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' A' ' 323' ' ' LEU . 10.2 t-20 -118.28 148.23 42.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.212 -0.904 . . . . 0.0 108.578 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.63 ' H ' ' CD ' ' A' ' 322' ' ' GLU . 5.7 mp0 -61.06 78.98 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.575 ' N ' ' O ' ' A' ' 321' ' ' ASN . 0.7 OUTLIER . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 117.983 -1.008 . . . . 0.0 111.061 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.6 t -62.53 139.56 58.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.946 0.403 . . . . 0.0 110.463 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -145.0 149.14 34.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.585 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -131.57 154.08 49.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.422 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.447 ' O ' ' O ' ' A' ' 6' ' ' ASN . 99.2 mttt -128.0 155.28 44.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.323 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.447 ' O ' ' O ' ' A' ' 5' ' ' LYS . 9.9 m120 -56.87 -153.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.953 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.543 ' N ' ' OE1' ' A' ' 7' ' ' GLN . 4.4 mp0 -123.73 83.76 54.04 Favored Pre-proline 0 CA--C 1.531 0.236 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.886 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -62.61 147.27 95.01 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.704 2.269 . . . . 0.0 112.124 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.488 ' CB ' ' HZ3' ' A' ' 9' ' ' LYS . 9.3 mtpm? -130.94 62.03 63.09 Favored Pre-proline 0 N--CA 1.462 0.171 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 179.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.65 154.33 59.6 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 122.924 2.416 . . . . 0.0 112.174 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.572 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.2 OUTLIER -94.63 -43.9 0.29 Allowed Pre-proline 0 C--N 1.332 -0.178 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.903 -179.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 11' ' ' SER . 24.6 Cg_exo -61.48 145.58 97.83 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.481 2.121 . . . . 0.0 111.845 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -158.52 -46.22 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.588 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.2 ptt-85 -66.14 -38.53 88.36 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -59.09 -16.9 21.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.612 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -65.69 146.07 55.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.649 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 164.69 132.96 1.42 Allowed Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -127.13 131.58 50.76 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.819 0.342 . . . . 0.0 110.574 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -69.65 -43.76 71.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -98.97 176.77 5.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.765 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -63.74 -39.23 93.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.816 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 93.4 mmm -125.31 153.5 43.18 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.056 0.455 . . . . 0.0 110.875 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -60.75 -37.42 81.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.572 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.6 tttp -58.06 -47.16 83.99 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.261 0.553 . . . . 0.0 110.615 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.05 -39.78 93.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.359 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -64.06 -38.66 91.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.11 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.3 -46.37 88.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.433 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.0 mt -61.7 -43.19 99.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.094 0.473 . . . . 0.0 109.87 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.597 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 52.6 t-105 -61.62 -43.39 98.94 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.214 0.531 . . . . 0.0 110.233 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -57.66 -42.11 82.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.029 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.58 -41.63 97.7 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.159 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.62 87.46 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.124 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.597 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -62.89 -36.99 85.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.055 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -60.99 -43.14 99.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.337 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -63.56 -39.67 95.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.384 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.81 106.94 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -130.42 154.82 81.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.795 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -37.96 155.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.776 2.317 . . . . 0.0 112.055 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.64 -39.87 11.18 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.546 2.164 . . . . 0.0 112.248 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.28 -48.68 84.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.999 0.428 . . . . 0.0 110.534 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -68.29 -39.54 82.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.711 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -62.9 -44.09 97.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.526 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.65 94.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.274 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -66.87 -46.59 74.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.569 HD13 ' OH ' ' A' ' 88' ' ' TYR . 5.2 tt -63.47 -45.78 89.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.547 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -58.39 -43.34 88.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.107 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.472 ' O ' HG13 ' A' ' 51' ' ' ILE . . . -63.14 -41.71 99.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.642 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -56.55 -51.64 67.81 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.917 0.389 . . . . 0.0 110.734 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.84 -38.57 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.372 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -57.79 -45.07 86.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.201 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 47' ' ' ALA . 2.2 mt -63.5 -42.67 97.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.475 ' NE2' HD21 ' A' ' 80' ' ' ASN . 29.5 mm-40 -51.67 -46.19 63.71 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.673 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -64.62 -38.7 91.89 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.908 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -61.52 -44.59 96.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.96 0.409 . . . . 0.0 110.406 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -62.3 -41.57 98.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.377 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -57.3 -49.55 75.73 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.749 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.09 -41.95 93.57 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.967 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.641 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.508 ' NE1' ' OD2' ' A' ' 68' ' ' ASP . 53.8 t90 -59.1 -41.98 89.41 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.096 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -63.6 -45.16 91.59 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -57.57 -51.57 68.94 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.73 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 pp -65.34 -39.15 92.03 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.808 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -58.25 -42.28 86.05 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 38.3 tp -63.03 -40.22 97.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.637 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.83 -23.1 67.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.076 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.8 56.56 0.85 Allowed Glycine 0 C--N 1.335 0.478 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 89.7 mt -132.48 -164.62 1.49 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.822 -0.689 . . . . 0.0 110.346 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.508 ' OD2' ' NE1' ' A' ' 59' ' ' TRP . 43.8 t0 54.23 102.39 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.414 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -113.12 -48.69 2.96 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.842 0.353 . . . . 0.0 110.67 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -62.98 -40.2 97.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.693 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 87.43 11.27 69.28 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -62.42 -31.44 72.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.696 0.284 . . . . 0.0 110.275 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.89 -52.64 64.54 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.047 0.451 . . . . 0.0 110.271 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -61.14 -42.17 98.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.08 179.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.01 90.58 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.239 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -61.19 -43.14 99.35 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.36 -44.05 97.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.39 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.53 -46.9 91.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 120.97 0.414 . . . . 0.0 110.283 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -62.88 -42.49 99.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.229 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.475 HD21 ' NE2' ' A' ' 52' ' ' GLN . 33.3 t30 -64.01 -39.67 94.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.449 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.412 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.71 -48.55 81.21 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.632 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -64.86 -39.32 93.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.586 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 79.4 t -62.84 -45.62 98.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.343 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -61.38 -48.61 88.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.583 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.26 -41.61 94.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.893 0.377 . . . . 0.0 110.542 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.52 89.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.721 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -63.41 -47.95 79.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.596 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.569 ' OH ' HD13 ' A' ' 45' ' ' LEU . 17.9 m-85 -68.87 -30.9 69.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.505 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.48 25.26 36.58 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.92 8.04 42.75 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.529 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 47.1 p-10 -82.89 45.97 1.05 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.394 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.68 149.07 51.5 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 111.224 -0.75 . . . . 0.0 111.224 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt -127.59 -31.4 2.48 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.664 0.269 . . . . 0.0 110.654 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -117.58 148.37 41.97 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.591 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -114.22 163.29 15.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.794 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -157.56 67.35 0.5 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.527 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -133.43 138.22 46.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.562 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -143.3 -66.21 0.37 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.571 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 4.6 t 43.95 -118.65 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.458 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 56.4 p -143.51 -159.7 1.02 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.262 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 98.6 p -131.96 157.38 44.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.394 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.608 ' O ' ' N ' ' A' ' 104' ' ' LEU . 27.6 t-20 -92.7 106.51 18.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.703 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.4 t 45.37 -84.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.794 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.608 ' N ' ' O ' ' A' ' 102' ' ' ASN . 10.5 mp -76.02 130.31 38.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.942 0.401 . . . . 0.0 110.412 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 61.3 p -64.16 -34.82 78.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.564 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 77.7 63.99 2.12 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 56.7 m -104.64 120.82 42.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.772 0.32 . . . . 0.0 110.359 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 94.1 mm-40 -128.68 45.43 2.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.314 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.425 ' O ' ' OD1' ' A' ' 110' ' ' ASP . 71.5 mm-40 -83.7 120.21 25.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.634 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 109' ' ' GLU . 73.9 m-20 -152.01 117.19 5.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.597 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.36 125.18 4.79 Favored Glycine 0 C--N 1.334 0.421 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.458 ' O ' ' CD ' ' A' ' 118' ' ' GLU . 4.7 mp -60.37 129.74 43.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.048 0.451 . . . . 0.0 110.649 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -73.07 -45.9 54.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.595 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -42.09 116.15 1.67 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.625 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -66.96 -27.66 42.71 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.219 1.946 . . . . 0.0 112.271 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -69.98 -45.74 66.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.806 0.336 . . . . 0.0 111.278 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 53.7 mt -71.02 -37.05 72.6 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.186 0.517 . . . . 0.0 110.865 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.676 ' OE1' ' NE2' ' A' ' 122' ' ' HIS . 27.0 mm-40 -56.04 -25.08 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.194 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 53.4 mttp -61.27 -49.06 78.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.28 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.38 -45.09 70.15 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.998 0.428 . . . . 0.0 111.622 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.412 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 8.6 t-105 -57.72 -49.72 75.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.324 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.676 ' NE2' ' OE1' ' A' ' 118' ' ' GLU . 12.6 m-70 -66.27 -35.6 80.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.385 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 127' ' ' SER . 14.0 tptt -55.83 -50.89 69.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.819 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.489 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.46 -47.38 64.16 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.105 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -53.98 -51.85 62.59 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.789 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -75.02 -43.91 50.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.005 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 22.4 p -46.6 -28.16 1.36 Allowed 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -178.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.49 -95.42 0.11 Allowed Glycine 0 CA--C 1.519 0.314 0 C-N-CA 119.996 -1.097 . . . . 0.0 111.525 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.04 32.23 0.08 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.563 ' CG ' ' OE1' ' A' ' 134' ' ' GLU . 3.9 m-85 -66.81 49.85 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.469 -179.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.7 m -104.11 124.11 48.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.008 0.433 . . . . 0.0 111.995 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 109.2 -97.49 1.06 Allowed Glycine 0 CA--C 1.53 0.976 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.384 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -78.62 -43.31 26.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.858 0.361 . . . . 0.0 111.329 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.563 ' OE1' ' CG ' ' A' ' 130' ' ' PHE . 56.7 mt-10 -60.58 -51.35 69.8 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.209 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.4 mt -63.27 -42.86 99.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.502 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -61.17 -42.0 97.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.568 ' HA ' ' HE ' ' A' ' 140' ' ' ARG . 97.1 mttt -61.88 -41.1 97.48 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.167 0.508 . . . . 0.0 110.002 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.66 -41.73 91.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -34.16 77.4 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 177.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.581 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 53.9 mtm180 -57.56 -45.99 84.47 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.842 -1.143 . . . . 0.0 108.202 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -71.9 -38.1 70.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.938 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.88 -58.25 9.45 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.786 -179.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.65 -40.73 95.96 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.066 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.581 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 47.6 m170 -56.74 -44.34 81.58 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.726 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -60.67 -42.39 96.98 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.606 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -60.54 -43.48 97.14 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.744 -0.383 . . . . 0.0 111.386 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.518 ' HA ' ' HD1' ' A' ' 150' ' ' HIS . 98.6 mt-10 -65.98 -55.78 15.02 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.703 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.23 -42.68 99.26 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.56 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.56 -45.42 98.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.144 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.659 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 1.1 p-80 -65.5 -36.27 83.35 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.931 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.602 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 94.2 mt-10 -59.39 -46.23 89.26 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.997 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -61.72 -45.18 95.06 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.684 -0.406 . . . . 0.0 109.955 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.65 -39.29 91.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.15 -47.84 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 62.6 mt -63.52 -42.88 98.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.51 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.514 ' O ' ' OG ' ' A' ' 160' ' ' SER . 34.2 mt -62.45 -42.7 99.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.539 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.75 -33.22 75.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.952 0.406 . . . . 0.0 110.264 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 65.3 m -65.21 -49.11 70.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.971 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.434 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 1.6 pp -78.95 -21.17 47.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.633 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.514 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 36.6 m -60.12 -28.51 67.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.521 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.8 mtp180 -58.11 -44.64 87.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.036 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.65 ' C ' ' H ' ' A' ' 164' ' ' GLU . 12.3 p -83.6 -179.68 7.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.365 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 65.1 -36.93 0.22 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.139 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.65 ' H ' ' C ' ' A' ' 162' ' ' THR . 80.6 tt0 -92.9 57.36 2.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.432 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 18.2 tt -134.84 143.07 38.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.082 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -81.94 109.35 16.21 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -173.62 81.04 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.26 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 11.9 m120 48.03 98.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.95 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 51.9 t -111.3 102.69 14.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.569 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 18.8 tt -169.77 142.82 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.642 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 1.4 p -159.88 154.92 21.36 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.588 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.45 -41.86 64.78 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.57 2.18 . . . . 0.0 112.414 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.46 ' O ' ' OG ' ' A' ' 173' ' ' SER . 9.6 p 57.31 98.37 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -87.38 -23.8 24.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.696 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.659 ' O ' ' N ' ' A' ' 177' ' ' ASP . 7.1 mp -117.0 122.68 44.94 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.545 ' OG ' ' N ' ' A' ' 177' ' ' ASP . 82.0 p 43.7 -85.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.076 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.659 ' N ' ' O ' ' A' ' 175' ' ' LEU . 50.2 p30 -143.6 24.41 1.72 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.879 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 1.5 pp -138.83 156.74 28.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.433 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -62.91 -39.81 95.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.43 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 67.23 140.13 0.06 OUTLIER Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 1.7 m 174.86 -58.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.749 0.309 . . . . 0.0 110.485 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 10.9 t -137.99 3.46 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.021 0.438 . . . . 0.0 110.627 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 20.8 mt -62.59 -39.61 94.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -44.73 -39.88 5.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.608 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 74.4 m -61.83 -44.88 95.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.387 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -65.22 -41.55 94.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.265 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -64.85 -40.92 95.93 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.114 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 61.7 m -63.45 -44.58 94.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.966 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -65.65 -41.09 92.98 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.271 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 7.6 mt -61.97 -47.54 84.38 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.444 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.493 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.6 mtmt -70.22 -37.73 75.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.939 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -67.67 -51.02 54.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.46 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 18.4 pttt -67.13 -42.9 83.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.313 -179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.515 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -70.06 -40.49 75.05 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.632 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.493 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 25.3 mmt180 -64.06 -39.5 94.22 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.244 -0.583 . . . . 0.0 109.643 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 78.4 p -62.68 -44.3 96.6 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.456 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.97 -44.4 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.91 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -63.37 -41.56 98.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.826 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 70.6 mt-30 -66.03 -29.54 69.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.123 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.59 -47.22 63.37 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 32.8 mt -64.44 -42.89 95.72 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.873 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.826 ' OD1' ' O ' ' A' ' 199' ' ' GLN . 0.4 OUTLIER -65.85 -35.38 80.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.0 tmt_? -63.42 -42.93 98.74 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.19 -40.57 96.52 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -62.65 -42.66 99.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.867 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.767 ' O ' ' N ' ' A' ' 210' ' ' GLN . 67.9 mtp180 -65.23 -38.34 90.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.064 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.459 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 52.9 t -64.07 -47.64 89.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.906 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.8 m -71.16 -29.5 65.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.496 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -93.93 -42.27 9.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.372 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.767 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.7 tt0 -105.04 -35.83 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.11 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.459 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . -63.07 -31.87 82.18 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.614 ' O ' ' O ' ' A' ' 213' ' ' SER . 45.6 t80 -42.78 97.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.704 0.287 . . . . 0.0 110.546 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.738 ' O ' ' O ' ' A' ' 214' ' ' THR . 27.9 t 50.11 158.98 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.134 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.738 ' O ' ' O ' ' A' ' 213' ' ' SER . 12.0 t 46.04 150.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.87 0.367 . . . . 0.0 111.01 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 214' ' ' THR . 84.4 tt0 177.03 158.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.283 179.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . 0.423 ' N ' ' HG2' ' A' ' 215' ' ' GLU . . . -150.25 146.06 26.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.394 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -151.0 -6.93 0.26 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.814 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.438 ' O ' ' HB3' ' A' ' 219' ' ' GLU . 96.1 m-85 -122.29 166.33 14.82 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 218' ' ' PHE . 82.3 tt0 71.68 -8.86 1.01 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.49 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.421 ' H ' ' C ' ' A' ' 218' ' ' PHE . 27.6 mt-10 -56.06 157.47 8.52 Favored Pre-proline 0 C--O 1.232 0.178 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.912 -179.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.484 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 35.3 Cg_exo -56.88 -171.36 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.373 2.049 . . . . 0.0 111.863 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.484 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 0.2 OUTLIER 82.82 -85.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.87 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.681 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 4.7 p -62.46 -69.22 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.727 0 CA-C-O 121.321 0.581 . . . . 0.0 111.838 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.681 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 0.5 OUTLIER -56.57 -34.33 41.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . 0.418 ' HB2' ' N ' ' A' ' 222' ' ' ARG . 6.4 m-20 -64.42 -37.0 86.0 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.089 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.45 -42.81 96.9 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . 0.43 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 42.7 m0 -61.73 -38.75 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.15 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -61.54 -38.28 86.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 231' ' ' GLN . 92.3 mt -64.7 -42.06 95.55 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.482 0.658 . . . . 0.0 110.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -45.38 -19.23 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.902 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.447 ' N ' ' O ' ' A' ' 229' ' ' LEU . 8.9 tt0 -75.13 -69.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.628 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.439 ' O ' ' O ' ' A' ' 233' ' ' ALA . 5.0 m -73.3 -19.05 61.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.562 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -44.04 -96.0 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.668 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -168.87 93.7 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.703 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 85.8 mt -141.24 163.83 31.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.649 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.2 p -78.37 166.15 22.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.64 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 237' ' ' ASP . 60.0 t0 -66.07 -48.74 69.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.154 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -62.13 -46.74 87.66 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.123 0.487 . . . . 0.0 110.451 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . 0.472 ' OE1' ' O ' ' A' ' 321' ' ' ASN . 80.4 tt0 -62.19 -40.02 94.65 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.292 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 17.3 mt -65.54 -34.2 77.7 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.772 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -63.67 -51.87 63.18 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.084 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -65.36 -41.8 93.43 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.344 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.449 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.7 OUTLIER -66.25 -43.06 87.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.403 179.318 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -58.94 -47.55 84.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.195 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -68.18 -42.6 79.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.703 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -57.03 -51.4 69.4 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.13 0.49 . . . . 0.0 110.43 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.479 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 2.3 mm? -63.62 -38.92 92.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.529 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.415 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 38.4 ttpt -54.82 -45.04 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -66.14 -40.1 90.34 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.552 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . 0.456 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 23.5 t80 -58.07 -50.15 74.44 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.317 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 7.7 pt-20 -62.81 -36.67 83.92 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.86 -38.52 86.51 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.563 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.81 -46.57 87.36 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.243 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -66.08 -39.82 85.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.172 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.19 -46.07 92.0 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.162 0.506 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -61.66 -44.84 96.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.966 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . 0.483 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -54.47 -43.02 71.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . 0.483 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 47.2 t30 -60.8 -41.25 95.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.305 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -59.99 -48.29 82.32 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.521 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -62.32 -36.22 81.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -60.58 -42.63 97.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.12 -47.56 85.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.124 0.487 . . . . 0.0 109.86 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -64.06 -35.67 81.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.922 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 62.8 tp -62.04 -41.81 98.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.954 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -63.85 -46.23 85.94 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 110.475 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 67.2 mt -62.74 -43.41 98.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.97 82.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.025 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -61.56 -46.2 90.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -58.09 -48.67 79.45 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.098 0.475 . . . . 0.0 110.119 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -62.46 -35.8 80.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.378 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 3.1 tt -59.07 -44.68 91.87 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -63.84 -41.25 97.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.276 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -66.04 -45.04 82.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.659 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . 0.45 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -62.32 -34.88 77.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.886 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . 0.403 ' OE2' ' CG1' ' A' ' 283' ' ' VAL . 41.6 mm-40 -57.67 -31.42 66.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.893 0.377 . . . . 0.0 110.342 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 5.4 m -87.15 6.79 31.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.926 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.461 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 12.3 p -60.38 -45.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.759 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.461 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 160.25 -113.0 0.55 Allowed Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -61.32 -47.86 83.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.716 0.294 . . . . 0.0 110.654 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . 0.451 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 135.14 -102.77 0.44 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 65.73 -60.43 0.28 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.931 0.396 . . . . 0.0 110.368 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -67.1 -17.33 64.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.281 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . 0.403 ' CG1' ' OE2' ' A' ' 275' ' ' GLU . 81.3 t -63.81 -43.3 97.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.803 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 284' ' ' SER . . . . . 0.434 ' O ' ' HG2' ' A' ' 287' ' ' ARG . 5.8 t -59.22 -45.72 90.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.156 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -69.63 -43.85 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 4.4 p -61.27 -48.6 80.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.932 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 284' ' ' SER . 34.9 ptt180 -65.58 -34.88 79.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 110.467 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.24 -65.1 0.7 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.092 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . 0.433 ' HZ2' HD21 ' A' ' 292' ' ' LEU . 25.6 mmtt -63.04 -39.21 94.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.824 -0.75 . . . . 0.0 109.961 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -43.94 -55.78 4.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.076 0.465 . . . . 0.0 110.051 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.24 79.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.883 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . 0.433 HD21 ' HZ2' ' A' ' 289' ' ' LYS . 18.1 tp -59.78 -53.21 60.63 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.838 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.21 -42.26 96.68 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.253 0.549 . . . . 0.0 110.31 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.504 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.0 tt0 -61.93 -37.68 85.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.786 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.48 -43.67 97.83 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -59.45 -44.44 92.97 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.356 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.504 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 44.8 p -59.17 -44.61 92.16 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.654 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . 0.468 ' N ' ' HG1' ' A' ' 297' ' ' THR . 39.7 ttmt -62.36 -45.32 93.7 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.638 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.79 -38.88 89.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.202 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.26 96.71 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.35 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.69 -42.71 98.04 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -61.3 -44.23 97.56 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.995 0.426 . . . . 0.0 110.573 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.8 m -60.44 -43.92 96.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.656 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.83 -43.38 91.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -57.8 -51.78 68.19 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.824 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -63.61 -40.92 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.462 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -63.62 -36.42 83.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.929 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 7.8 mt -62.02 -44.38 96.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.614 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.4 -47.81 69.22 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.943 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.46 -48.14 82.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.2 -39.45 94.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.576 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.2 t -58.93 -44.42 91.37 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.15 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . 0.495 ' O ' ' OG ' ' A' ' 316' ' ' SER . . . -67.63 -41.75 89.1 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 317' ' ' ARG . 94.3 mtt-85 -64.41 -45.13 88.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.917 0.389 . . . . 0.0 111.233 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.9 mm -72.52 -18.03 18.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.712 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.495 ' OG ' ' O ' ' A' ' 313' ' ' GLY . 71.8 p -50.49 -34.82 26.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.49 ' N ' ' HG ' ' A' ' 316' ' ' SER . 0.3 OUTLIER -143.22 157.65 44.31 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 178.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.429 ' O ' ' O ' ' A' ' 319' ' ' ARG . . . -143.55 100.95 3.69 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 119.959 -0.697 . . . . 0.0 110.71 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' A' ' 318' ' ' ALA . 39.4 mmm-85 -43.74 175.1 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.055 -0.975 . . . . 0.0 112.235 -178.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -59.91 -50.41 73.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.196 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.472 ' O ' ' OE1' ' A' ' 239' ' ' GLU . 70.7 m-80 -94.74 -99.77 0.15 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.153 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -119.57 135.63 54.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.326 -0.455 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.904 -179.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.5 m -60.04 -42.73 95.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 51.9 69.31 0.68 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.042 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -126.04 134.0 51.56 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.496 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 6' ' ' ASN . 30.5 tptt -162.45 60.41 0.22 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.658 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.46 ' O ' ' O ' ' A' ' 5' ' ' LYS . 95.9 m-20 41.06 -165.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.542 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -144.72 146.42 31.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.63 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -68.95 -89.96 0.0 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 123.068 2.512 . . . . 0.0 113.092 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm 50.59 67.51 4.28 Favored Pre-proline 0 C--O 1.234 0.239 0 CA-C-O 120.838 0.351 . . . . 0.0 110.444 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.426 ' O ' ' CB ' ' A' ' 11' ' ' SER . 73.9 Cg_endo -73.79 -16.81 23.33 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 123.199 2.599 . . . . 0.0 113.021 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 10' ' ' PRO . 1.2 p 74.86 149.41 0.12 Allowed Pre-proline 0 C--N 1.33 -0.245 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.16 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.99 150.7 55.18 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.71 2.274 . . . . 0.0 112.15 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -158.79 113.15 2.46 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.498 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -145.99 164.61 31.52 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.142 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -139.91 146.0 38.69 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.172 0.51 . . . . 0.0 111.281 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.3 m -74.67 -87.49 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.172 -178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 79.38 9.23 87.16 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.844 -0.502 . . . . 0.0 111.844 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -68.65 136.36 52.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.648 0.261 . . . . 0.0 110.567 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -130.37 -34.74 1.58 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.902 0.382 . . . . 0.0 110.465 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -98.47 -175.88 3.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.577 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.5 ptt85 -91.29 -6.4 53.22 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.548 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.506 ' SD ' ' NZ ' ' A' ' 24' ' ' LYS . 3.6 mmt -137.45 144.46 42.33 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.767 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.692 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 46.6 tp10 -66.13 -53.12 41.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.465 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.506 ' NZ ' ' SD ' ' A' ' 22' ' ' MET . 8.0 pttm -51.58 -43.74 62.55 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.239 0.542 . . . . 0.0 110.322 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.2 tp -61.62 -42.95 99.61 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.386 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.723 ' OD1' ' N ' ' A' ' 27' ' ' GLN . 1.5 p-10 -65.25 -25.35 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.234 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.723 ' N ' ' OD1' ' A' ' 26' ' ' ASN . 92.2 mt-30 -69.47 -45.62 68.58 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.921 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.83 -41.68 98.09 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.387 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.495 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 41.2 t-105 -61.82 -46.04 91.22 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.342 0.592 . . . . 0.0 110.399 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -57.86 -41.31 82.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.182 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -60.91 -41.76 96.75 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.183 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.93 86.85 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.205 0.526 . . . . 0.0 110.415 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.495 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 75.0 mt-30 -58.29 -39.12 78.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.241 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -62.78 -41.54 99.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.511 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.13 -34.84 77.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.262 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.57 107.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.869 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.2 mt -129.05 154.54 80.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.572 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -41.63 153.32 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.529 2.153 . . . . 0.0 112.206 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -57.2 -47.31 23.14 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.724 2.283 . . . . 0.0 112.327 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 69.5 t -64.29 -47.19 90.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.667 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -63.2 -41.87 99.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.389 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.0 tt -62.3 -43.01 99.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.629 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.5 -41.2 96.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.453 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -69.92 -42.54 73.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.496 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.97 -48.88 78.37 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -61.84 -40.54 95.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.21 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.43 -47.0 87.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.6 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.926 ' O ' HG22 ' A' ' 51' ' ' ILE . 50.3 t0 -59.43 -49.84 76.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.119 0.485 . . . . 0.0 110.293 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.63 -41.4 99.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.1 0.476 . . . . 0.0 110.441 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.26 -47.45 85.95 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.35 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.926 HG22 ' O ' ' A' ' 48' ' ' ASP . 16.9 tt -59.51 -36.82 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.404 HE22 HD22 ' A' ' 81' ' ' LEU . 52.2 tt0 -60.96 -42.42 98.26 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -61.07 -40.29 93.09 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.85 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -62.92 -44.29 96.48 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.728 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -60.98 -41.28 96.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.485 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -57.78 -48.49 79.54 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.005 0.431 . . . . 0.0 110.186 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.3 tp -59.99 -41.43 92.02 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.11 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.13 93.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.299 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.6 t90 -58.34 -44.97 88.95 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.067 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.58 -46.22 91.04 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.54 -41.87 86.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.181 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.12 -40.04 96.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.962 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.72 -42.98 84.91 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 39.4 mt -62.89 -40.29 97.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.103 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -64.33 -36.22 83.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.144 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.36 54.59 1.44 Allowed Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.194 -0.762 . . . . 0.0 111.194 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 75.3 mt -119.53 -56.35 2.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.757 0.313 . . . . 0.0 110.598 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -71.39 136.8 47.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.296 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -154.95 -29.38 0.11 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.572 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -64.64 -35.61 81.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.526 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.78 -1.65 81.29 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -58.95 -36.18 74.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.359 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 73' ' ' LYS . 13.6 mptt -56.65 -68.58 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.099 0.476 . . . . 0.0 109.958 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -46.04 -38.95 8.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.16 94.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.559 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -63.64 -38.96 93.09 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 mp -64.32 -45.07 89.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.11 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.07 -45.91 95.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.177 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.2 ttt-85 -59.57 -43.85 93.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.112 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -62.63 -39.74 94.78 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.112 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.466 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.22 -50.92 71.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.285 0.564 . . . . 0.0 110.239 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.409 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 30.0 t-20 -64.97 -37.32 87.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.699 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 73.2 t -63.27 -45.88 97.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.393 -179.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.405 HD13 HG22 ' A' ' 84' ' ' ILE . 96.6 mt -61.16 -49.98 82.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.507 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.449 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.6 mm? -66.55 -42.02 87.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.019 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.24 94.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.06 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -62.38 -47.9 82.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.855 -179.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.08 -26.6 68.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.265 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.19 8.12 78.95 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.969 -0.853 . . . . 0.0 110.969 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.5 mt -76.05 -18.52 59.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.827 0.346 . . . . 0.0 110.557 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.42 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 23.6 p-10 -65.14 -35.26 80.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.968 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -157.36 179.83 32.82 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.4 mttp -132.14 150.63 52.11 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.897 0.379 . . . . 0.0 110.347 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -130.27 76.41 1.72 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.527 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -89.92 165.36 14.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.29 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -132.53 -178.05 4.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.409 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -66.0 135.81 55.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.609 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -159.78 80.21 0.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.587 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 67.8 t -123.56 129.99 74.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.994 0.426 . . . . 0.0 110.58 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.3 m 45.09 92.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.912 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.8 t -136.99 143.41 42.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.437 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.402 ' O ' ' OD1' ' A' ' 102' ' ' ASN . 41.7 p-10 -120.49 120.97 37.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.52 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 87.9 p -62.24 -36.32 81.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.372 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.452 ' O ' ' OG ' ' A' ' 105' ' ' SER . 8.7 tp -84.03 149.97 25.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.587 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.452 ' OG ' ' O ' ' A' ' 104' ' ' LEU . 12.2 p 62.28 163.38 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.357 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.13 88.92 0.07 OUTLIER Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.656 -0.977 . . . . 0.0 110.656 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.8 t -140.44 161.63 37.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.861 0.362 . . . . 0.0 110.451 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -139.74 148.05 41.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.524 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -177.4 45.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.553 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -119.06 21.78 12.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.639 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.13 -113.44 1.54 Allowed Glycine 0 N--CA 1.462 0.419 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.5 tp -142.31 1.05 1.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.751 0.31 . . . . 0.0 110.76 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.54 ' N ' ' OE2' ' A' ' 118' ' ' GLU . 50.9 t0 61.15 24.04 14.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.72 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 113' ' ' ASP . 37.7 m-20 -139.23 102.0 7.48 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.505 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -50.5 -40.97 53.96 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.566 2.177 . . . . 0.0 112.297 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -62.68 -42.26 99.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.921 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.0 mt -85.79 -36.28 20.19 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.629 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 94.7 mt-10 -62.4 -28.69 69.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.505 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.542 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 11.2 mmmt -60.96 -46.62 90.0 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.574 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.35 -46.79 66.17 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 120.948 0.404 . . . . 0.0 111.796 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.415 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 11.9 t-105 -59.25 -47.08 86.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.605 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.629 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.1 m-70 -69.73 -34.22 73.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.615 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.542 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 10.6 tptt -57.92 -52.0 67.32 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.178 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.818 ' O ' ' O ' ' A' ' 128' ' ' GLY . . . -73.61 -46.7 45.44 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.523 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -50.09 -39.79 43.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.669 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.483 ' C ' ' H ' ' A' ' 128' ' ' GLY . 20.8 m -97.69 -66.67 0.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.708 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.447 ' O ' ' OH ' ' A' ' 212' ' ' TYR . 1.5 m -55.74 -7.0 0.24 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.419 -178.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 1.153 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -160.25 98.38 0.17 Allowed Glycine 0 C--O 1.226 -0.373 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.421 ' C ' ' H ' ' A' ' 131' ' ' SER . 72.8 mmtt -41.98 44.78 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.355 0.598 . . . . 0.0 109.928 -179.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 1.153 ' N ' ' O ' ' A' ' 128' ' ' GLY . 3.4 m-30 -81.05 32.09 0.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.385 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.421 ' H ' ' C ' ' A' ' 129' ' ' LYS . 6.2 m -85.13 128.45 34.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.008 0.432 . . . . 0.0 111.533 -179.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.45 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . 111.3 -98.17 1.01 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.356 177.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 74.7 mm-40 -79.17 -43.85 23.11 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.991 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 57.1 mp0 -62.44 -50.49 71.28 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.076 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 130' ' ' PHE . 2.7 mt -61.09 -42.09 97.87 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.363 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.45 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 96.2 m-20 -63.3 -37.71 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.936 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 23.1 mmtp -62.26 -44.25 96.97 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-O 121.266 0.555 . . . . 0.0 109.991 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.441 HD21 ' O ' ' A' ' 134' ' ' GLU . 3.2 mm? -60.21 -43.47 95.93 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.247 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.481 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -65.21 -36.64 84.79 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.058 176.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.607 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 86.5 mtt180 -53.53 -43.79 68.66 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -70.12 -38.37 75.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.76 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.481 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.1 m-85 -59.35 -58.54 8.16 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.59 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 67.0 mt -60.79 -38.84 86.7 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.022 -0.671 . . . . 0.0 110.26 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.607 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 61.3 m170 -53.15 -43.98 67.45 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.096 -0.642 . . . . 0.0 109.706 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.4 ' HD1' HG23 ' A' ' 197' ' ' ILE . 3.3 m-70 -64.09 -39.52 94.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.658 178.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -61.75 -44.46 96.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.33 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -68.26 -51.2 47.79 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.698 0.285 . . . . 0.0 111.516 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -61.58 -43.42 98.9 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.954 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 26.1 t -62.49 -43.36 98.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.021 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.606 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -63.21 -38.51 91.45 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.67 -47.68 84.26 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.279 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.46 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 23.0 m-85 -65.8 -46.62 77.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.551 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.82 79.89 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.504 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.606 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 77.9 t -63.31 -45.48 98.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.031 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.2 mt -64.04 -42.21 97.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.519 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.528 ' O ' ' OG ' ' A' ' 160' ' ' SER . 20.2 mt -62.68 -45.26 93.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.641 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -67.83 -27.3 66.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.058 0.456 . . . . 0.0 110.229 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 65.4 m -67.83 -50.75 55.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.912 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.515 ' O ' ' OG1' ' A' ' 162' ' ' THR . 1.3 pp -79.46 -20.86 46.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.699 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.528 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 43.9 m -60.86 -38.12 84.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.672 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.591 ' C ' ' H ' ' A' ' 163' ' ' GLU . 76.3 mtp180 -63.28 -38.43 91.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.795 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.515 ' OG1' ' O ' ' A' ' 159' ' ' LEU . 11.8 p -67.53 35.86 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.671 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.591 ' H ' ' C ' ' A' ' 161' ' ' ARG . 86.0 tt0 -134.85 -40.52 0.77 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.09 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -100.66 28.82 4.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.251 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.475 ' O ' ' CG2' ' A' ' 165' ' ' ILE . 20.1 tt -55.73 110.13 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.908 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 45.5 m170 50.98 21.56 1.01 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.986 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 41.76 92.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.751 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.57 ' C ' HD21 ' A' ' 168' ' ' ASN . 0.3 OUTLIER -160.48 175.16 13.07 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.402 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 14.1 t 62.76 109.77 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 10.3 tp -143.73 129.55 15.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.583 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.06 160.22 43.8 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.435 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -77.5 93.18 1.09 Allowed 'Trans proline' 0 C--N 1.307 -1.636 0 C-N-CA 122.757 2.305 . . . . 0.0 112.176 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 19.5 t -153.84 142.23 20.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.644 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -61.99 -45.11 95.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.417 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.584 ' O ' ' N ' ' A' ' 177' ' ' ASP . 2.5 pt? -155.55 144.88 20.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.377 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 23.0 t 46.29 -85.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.524 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 175' ' ' LEU . 5.1 p30 -173.84 24.44 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.737 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.511 ' H ' HD12 ' A' ' 178' ' ' ILE . 1.0 OUTLIER -134.76 160.01 41.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.999 179.856 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -66.63 -38.82 87.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.376 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 161.43 14.01 0.03 OUTLIER Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 6.0 t -64.88 -23.64 67.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.789 0.328 . . . . 0.0 110.671 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.632 ' C ' ' H ' ' A' ' 184' ' ' HIS . 22.9 t -137.08 178.97 4.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.676 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.629 ' H ' ' CG1' ' A' ' 182' ' ' VAL . 2.9 mt 65.68 -16.23 0.11 Allowed 'General case' 0 C--O 1.239 0.515 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.632 ' H ' ' C ' ' A' ' 182' ' ' VAL . 30.9 p80 -57.81 -42.72 84.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.557 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.614 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 90.0 p -62.24 -43.07 99.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.045 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.538 ' HE ' ' CD2' ' A' ' 183' ' ' LEU . 56.2 mtm-85 -60.62 -41.07 94.09 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.83 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -66.57 -41.2 88.93 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.172 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 55.6 m -62.84 -44.55 95.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.232 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -61.69 -40.62 95.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.141 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.573 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 7.1 mt -62.47 -43.35 99.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.866 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.6 mttm -70.67 -32.72 70.08 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.602 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.4 tt0 -68.42 -45.89 71.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.183 -178.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.573 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 7.8 ptmt -73.47 -44.61 57.62 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.498 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.562 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -65.18 -41.72 94.34 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.887 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.519 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -68.32 -36.58 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.819 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.422 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 63.8 m -61.45 -40.93 96.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 193' ' ' LYS . 96.6 mt -63.53 -43.95 98.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.518 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.8 -42.25 97.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -63.97 -37.39 87.24 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.568 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.98 -43.15 99.79 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 17.5 mt -64.06 -42.26 97.06 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.201 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.69 -38.38 90.19 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.778 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . 0.565 ' O ' HG11 ' A' ' 207' ' ' VAL . 31.7 mt -61.0 -39.01 88.07 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.413 179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 83.3 mtt-85 -64.12 -41.62 97.16 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.19 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.54 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.6 mtp180 -64.82 -42.85 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.769 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.565 HG11 ' O ' ' A' ' 204' ' ' LEU . 0.3 OUTLIER -63.77 -37.42 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.44 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.474 ' N ' HG11 ' A' ' 207' ' ' VAL . 25.4 m -75.96 -26.92 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.575 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -98.29 -15.08 19.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.033 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 206' ' ' ARG . 52.4 mt-30 -129.53 -39.07 1.5 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.696 -179.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -70.14 46.33 0.62 Allowed Glycine 0 CA--C 1.523 0.549 0 N-CA-C 111.392 -0.683 . . . . 0.0 111.392 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.482 ' CG ' ' N ' ' A' ' 213' ' ' SER . 20.5 t80 -89.49 -138.79 0.13 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.856 0.36 . . . . 0.0 110.333 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.772 ' O ' ' O ' ' A' ' 214' ' ' THR . 54.4 p -146.37 -62.56 0.31 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.917 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.772 ' O ' ' O ' ' A' ' 213' ' ' SER . 8.9 t 43.97 155.74 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.627 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -173.53 157.11 3.15 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.224 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.13 178.44 6.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.502 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.537 ' N ' ' OE1' ' A' ' 217' ' ' GLU . 56.1 mp0 -143.7 -11.77 0.68 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 110.017 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.438 ' CD2' HG23 ' A' ' 224' ' ' ILE . 42.2 m-85 -55.09 177.54 0.04 OUTLIER 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.504 179.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -51.43 -54.54 25.8 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -145.18 154.5 54.14 Favored Pre-proline 0 C--N 1.326 -0.431 0 C-N-CA 119.165 -1.014 . . . . 0.0 110.479 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.73 13.99 0.88 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.663 2.242 . . . . 0.0 112.147 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -124.58 -40.98 2.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.02 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.83 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 5.8 p -61.47 -78.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.246 0.916 0 CA-C-O 121.42 0.629 . . . . 0.0 110.869 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.83 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 1.1 mp -58.05 -25.54 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.45 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -63.24 -46.91 84.71 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.205 0.526 . . . . 0.0 109.844 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 24.5 mt -61.48 -40.99 96.53 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.677 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.0 m0 -61.39 -35.58 77.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.953 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -64.86 -37.28 87.1 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.735 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.6 mt -63.41 -41.27 98.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.968 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -60.03 20.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.0 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.735 ' H ' ' C ' ' A' ' 229' ' ' LEU . 13.8 tt0 -94.26 -44.82 7.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.668 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.2 p -121.03 -0.69 9.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.622 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.33 -103.52 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.587 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -141.53 95.39 2.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.505 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 3.8 mp -137.84 160.26 39.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.95 0.405 . . . . 0.0 110.562 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 33.9 p -85.44 -157.41 0.32 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.586 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' A' ' 238' ' ' LYS . 27.4 p-10 -96.34 -59.33 1.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.629 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . 0.498 ' H ' ' CG ' ' A' ' 237' ' ' ASP . 54.4 mtmt -62.25 -44.03 97.48 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 110.697 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -60.33 -32.0 70.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.163 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -43.24 96.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.189 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -63.73 -49.5 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.16 -38.23 85.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.042 0.449 . . . . 0.0 110.092 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.531 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.3 OUTLIER -68.21 -41.74 80.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.01 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -58.6 -52.25 66.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.96 0.41 . . . . 0.0 110.197 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.7 -42.27 95.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.577 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -56.5 -48.12 77.86 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.416 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.546 ' N ' HD21 ' A' ' 247' ' ' LEU . 1.4 mm? -63.49 -38.38 90.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.484 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.779 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 78.7 tttt -56.56 -44.81 81.29 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.347 0.594 . . . . 0.0 110.296 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -67.62 -38.57 84.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.488 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.35 -49.24 78.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.779 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.1 OUTLIER -60.5 -39.89 89.4 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.237 0.542 . . . . 0.0 109.873 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . 0.521 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.08 -36.86 84.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.266 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -62.37 -49.88 73.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.144 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.448 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.9 tt -61.91 -36.0 71.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.362 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -62.98 -45.9 90.26 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.166 0.508 . . . . 0.0 110.349 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -63.16 -44.77 94.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.536 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -55.96 -43.49 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.163 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -62.07 -40.97 97.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.19 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . 0.519 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 80.2 t60 -58.76 -48.21 82.02 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.413 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -63.52 -33.44 75.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.544 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.456 HE21 ' HB ' ' A' ' 297' ' ' THR . 64.3 mm-40 -61.63 -47.71 84.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.214 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . 0.411 ' HZ1' HD11 ' A' ' 266' ' ' ILE . 64.6 tttm -61.43 -46.25 90.87 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.051 0.453 . . . . 0.0 110.061 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . 0.519 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.6 mp0 -64.7 -35.18 80.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.242 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.82 -42.59 99.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.06 -46.24 85.23 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.467 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . 0.411 HD11 ' HZ1' ' A' ' 262' ' ' LYS . 87.1 mt -62.64 -43.37 98.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.346 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -63.26 -36.89 85.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.252 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -61.64 -47.73 84.05 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.332 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -64.54 -43.52 93.7 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.628 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.49 -43.09 99.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.518 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . 0.411 HD21 ' O ' ' A' ' 271' ' ' LEU . 6.1 tt -60.85 -44.38 97.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.322 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.97 -43.9 91.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.281 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -69.07 -47.32 65.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.663 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . 0.441 ' O ' ' CG2' ' A' ' 277' ' ' VAL . . . -60.43 -24.63 65.34 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.492 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -84.46 -1.74 56.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.476 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 42.2 m -120.06 -3.14 10.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.707 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.441 ' CG2' ' O ' ' A' ' 274' ' ' ALA . 16.8 m -63.33 -42.66 97.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.499 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 139.03 -82.9 0.25 Allowed Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.88 139.06 58.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.757 0.313 . . . . 0.0 110.402 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -107.41 116.44 4.92 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -145.49 -45.12 0.21 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.488 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -98.7 0.64 45.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.553 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.97 -48.29 88.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.538 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.5 t -63.36 -46.84 84.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.907 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.6 -41.65 96.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.739 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.0 t -62.47 -44.07 97.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -63.43 -41.61 98.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.498 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -60.34 -52.33 65.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.278 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -65.77 -33.42 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.135 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -56.45 -48.05 77.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.155 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.22 -40.44 71.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.968 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 3.5 tp -61.81 -50.67 71.39 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.26 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 23.9 tp -63.63 -41.48 98.25 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.4 tt0 -62.73 -37.72 87.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.022 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 299' ' ' GLU . . . -64.01 -47.03 89.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . 0.405 ' O ' ' HD2' ' A' ' 296' ' ' ARG . 15.4 tpt85 -57.82 -44.16 86.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.474 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 12.2 p -60.36 -48.1 83.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.346 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 295' ' ' GLY . 90.3 mt-10 -57.95 -55.33 36.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.592 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . 0.405 HD22 HH12 ' A' ' 296' ' ' ARG . 12.9 tp -61.56 -45.03 95.87 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.465 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -47.43 -47.02 22.88 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.084 -1.206 . . . . 0.0 110.084 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -65.48 -37.15 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.929 0.395 . . . . 0.0 109.967 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 20.0 m -60.47 -47.4 86.29 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.3 t -61.36 -46.13 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.376 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.41 -46.78 88.69 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.044 0.449 . . . . 0.0 110.284 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -58.56 -50.18 74.72 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.424 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.55 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.4 OUTLIER -65.07 -30.34 71.29 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.99 178.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . 0.431 ' O ' ' CB ' ' A' ' 312' ' ' SER . 1.4 tp -58.53 -46.58 86.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.056 -178.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -76.15 -54.49 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.813 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . 0.415 ' C ' ' OD1' ' A' ' 310' ' ' ASP . 61.6 t0 -58.96 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . 0.55 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 3.4 tp -61.67 -39.79 92.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.512 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 312' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 10.4 t -58.73 -43.56 90.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.665 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . 0.464 ' O ' ' OG ' ' A' ' 316' ' ' SER . . . -66.17 -40.12 94.8 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 317' ' ' ARG . 77.5 mtp180 -61.7 -43.46 98.82 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-O 120.693 0.282 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.7 -42.48 95.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.792 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.464 ' OG ' ' O ' ' A' ' 313' ' ' GLY . 83.6 p -49.67 -39.77 37.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.224 0.535 . . . . 0.0 109.649 -179.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 314' ' ' ARG . 22.4 tpp85 -117.98 122.82 44.2 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.643 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -131.68 99.42 4.78 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.289 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -100.23 -167.8 1.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.736 -178.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 79.3 m80 -70.0 -168.86 0.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.81 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 58.77 42.36 20.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.511 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 50.31 25.06 1.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.661 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 5.0 tt . . . . . 0 C--O 1.219 -0.502 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.378 179.955 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.8 p -88.54 -2.92 58.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.722 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 38.2 ptt-85 -62.89 137.04 58.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.726 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -170.58 116.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.536 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -165.02 99.66 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -161.51 171.25 18.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.688 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 54.84 92.6 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.378 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.61 142.91 95.8 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.398 2.065 . . . . 0.0 112.003 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 2.8 tmtm? -97.48 -42.65 0.25 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.62 ' CD ' ' N ' ' A' ' 9' ' ' LYS . 31.2 Cg_exo -61.57 146.62 96.77 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.751 2.301 . . . . 0.0 112.466 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.601 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER 171.33 -42.2 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.666 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 11' ' ' SER . 17.1 Cg_exo -64.28 151.5 85.19 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 C-N-CA 122.614 2.209 . . . . 0.0 111.913 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -66.51 153.11 43.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.378 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.7 ptm180 -63.01 137.25 58.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.598 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -137.43 151.18 48.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.2 p -138.87 152.72 48.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.568 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.38 178.51 25.39 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -166.68 121.33 1.1 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.858 0.361 . . . . 0.0 110.635 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -68.23 -34.78 76.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.651 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -124.57 167.26 14.72 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.787 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -88.68 2.39 53.37 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.723 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.436 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 3.7 mmt -143.11 140.06 30.71 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.375 0.607 . . . . 0.0 110.824 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.22 -36.26 81.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.306 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -56.5 -47.08 80.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.131 0.491 . . . . 0.0 110.542 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 99.3 mt -61.47 -40.17 93.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.856 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.436 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.5 m-80 -63.94 -37.4 87.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.169 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -60.39 -48.66 80.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.297 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.429 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 4.0 mm? -61.23 -42.38 98.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.205 179.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.509 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 34.1 t-105 -62.18 -44.53 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.229 0.538 . . . . 0.0 110.387 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -57.03 -44.96 83.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.246 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.6 -42.82 97.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.424 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.27 -41.85 80.5 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.218 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.509 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.2 mt-30 -64.7 -37.67 88.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.192 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -60.09 -43.62 95.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.449 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.39 -39.46 92.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.596 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.45 110.72 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.849 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -131.46 154.16 81.81 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.62 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -43.28 154.32 0.18 Allowed 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.618 2.212 . . . . 0.0 112.193 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.51 -42.04 69.74 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.582 2.188 . . . . 0.0 112.191 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.15 -49.71 82.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.551 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -66.47 -41.35 89.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 tp -64.26 -40.18 95.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.434 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -65.15 -38.86 91.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.466 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.37 -50.11 72.85 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.398 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -61.2 -39.97 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.444 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.94 92.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.425 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -60.56 -50.17 74.61 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.366 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.04 -39.3 94.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.383 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -56.55 -46.91 80.43 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.215 0.531 . . . . 0.0 110.142 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.7 mt -62.31 -42.73 96.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.761 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -51.51 -42.81 61.98 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -64.42 -41.26 96.7 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -61.4 -44.45 97.13 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.629 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -61.22 -41.62 97.17 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.373 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -54.75 -46.74 74.37 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.149 0.499 . . . . 0.0 110.062 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 23.8 mt -61.72 -41.4 97.57 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.334 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.94 -46.33 88.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.647 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.5 t90 -58.99 -39.9 83.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.342 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -59.89 -46.06 90.53 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.08 -41.51 92.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.114 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.36 -40.5 94.51 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.956 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.37 -43.3 96.69 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 51.5 tp -59.65 -42.64 93.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.889 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -67.23 -35.53 79.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.253 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 94.55 26.62 13.04 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 81.8 mt -81.07 -42.37 21.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.834 0.349 . . . . 0.0 110.906 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' A' ' 68' ' ' ASP . 54.4 p-10 -67.49 147.72 52.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.377 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -161.82 -51.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.596 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.59 -29.37 69.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.473 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 85.46 9.71 78.52 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -56.94 -36.63 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.863 0.363 . . . . 0.0 110.32 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -58.86 -64.78 0.81 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.853 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -44.87 -42.73 8.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.209 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.11 84.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.214 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -62.04 -41.58 98.27 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.86 -43.65 98.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.957 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.36 -47.72 90.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.106 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.7 mtt-85 -59.51 -43.35 93.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.924 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 84' ' ' ILE . 93.2 m-20 -64.33 -41.26 96.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.389 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.3 -48.33 71.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.008 0.432 . . . . 0.0 110.253 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -66.77 -36.48 82.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.366 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 75.1 t -63.85 -47.95 88.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.539 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 80' ' ' ASN . 48.6 mt -61.26 -50.34 80.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.631 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.22 -41.79 94.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.918 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.68 80.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.72 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.29 -44.77 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.844 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -59.47 -34.27 72.35 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.098 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 88.79 17.76 55.86 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.888 ' O ' ' N ' ' A' ' 92' ' ' GLY . 5.4 mt -83.29 -83.32 0.14 Allowed 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.506 ' CG ' ' H ' ' A' ' 92' ' ' GLY . 3.1 p-10 43.7 -65.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.951 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.888 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . 139.78 -175.66 21.66 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -93.8 5.08 52.83 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.632 0.253 . . . . 0.0 110.636 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt 64.04 41.58 6.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.77 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 46.7 p-10 -147.35 137.88 23.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.676 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -169.47 -64.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.657 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 55.39 80.91 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.457 ' OE1' ' O ' ' A' ' 98' ' ' GLN . 4.0 pp0? -175.47 25.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.736 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 85.5 t -63.89 -44.26 97.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.435 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 42.8 p -65.75 -18.42 65.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.317 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.6 m -59.5 -40.9 88.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.53 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -107.77 -177.65 3.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.571 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.584 ' O ' ' O ' ' A' ' 104' ' ' LEU . 52.1 m 56.15 50.59 13.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.432 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.584 ' O ' ' O ' ' A' ' 103' ' ' SER . 10.8 mp 51.09 155.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.691 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 17.3 m -78.66 146.35 34.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.251 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -161.85 68.76 0.23 Allowed Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 41.1 m -72.18 127.52 32.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.796 0.331 . . . . 0.0 110.244 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 108' ' ' GLN . 4.3 pp0? -167.94 148.49 5.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.556 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -160.89 20.7 0.13 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -98.67 111.38 23.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.969 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.3 124.61 4.63 Favored Glycine 0 CA--C 1.521 0.439 0 N-CA-C 111.254 -0.738 . . . . 0.0 111.254 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.554 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 19.7 mt -58.82 146.29 37.73 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.664 0.269 . . . . 0.0 110.366 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -90.16 -5.18 56.73 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.551 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.436 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -79.97 124.69 82.96 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.43 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.409 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 37.6 Cg_endo -65.76 -34.38 40.59 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.378 2.052 . . . . 0.0 112.625 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 48.7 mmm-85 -68.12 -45.82 72.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.093 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 46.8 mt -74.24 -33.75 63.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.616 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.554 ' OE2' ' O ' ' A' ' 112' ' ' LEU . 68.0 mt-10 -58.5 -33.35 69.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.811 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 52.7 mtpt -61.09 -48.35 82.11 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.901 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 13.5 mt -70.57 -46.83 62.75 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.966 0.412 . . . . 0.0 111.939 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.427 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 9.8 t-105 -59.38 -49.54 77.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.456 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.542 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.0 m-70 -71.16 -32.85 69.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.661 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.759 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 11.6 tptt -55.43 -51.65 66.19 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.949 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.09 -46.79 49.42 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.885 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -50.97 -48.75 61.03 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.969 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 12.4 m -83.91 -41.15 17.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.872 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.597 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 8.8 t -46.48 -26.1 0.8 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.296 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -159.09 -94.51 0.1 Allowed Glycine 0 N--CA 1.464 0.536 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.363 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' ' 131' ' ' SER . 13.2 pttp -161.52 24.08 0.12 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.96 44.74 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.318 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.56 ' H ' ' C ' ' A' ' 129' ' ' LYS . 6.1 p -103.44 136.42 43.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.083 0.468 . . . . 0.0 111.288 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 97.89 -97.1 1.89 Allowed Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.173 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 94.7 mt-10 -75.11 -43.81 50.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.806 0.336 . . . . 0.0 111.116 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.559 ' O ' HD23 ' A' ' 138' ' ' LEU . 53.3 mp0 -61.82 -54.38 43.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.421 HD21 ' CD2' ' A' ' 121' ' ' TRP . 1.8 mt -59.63 -40.51 87.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.323 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -60.77 -44.11 97.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 61.3 mttp -60.55 -44.17 96.42 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.559 HD23 ' O ' ' A' ' 134' ' ' GLU . 4.5 mm? -57.79 -39.11 76.76 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -73.28 -29.43 62.73 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.344 -0.843 . . . . 0.0 113.08 177.174 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.512 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 95.3 mtt-85 -57.38 -46.49 83.36 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.097 -1.041 . . . . 0.0 108.243 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.484 ' H ' ' HG2' ' A' ' 141' ' ' GLU . 6.1 pt-20 -72.71 -37.65 67.73 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.733 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.577 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.9 m-85 -55.75 -57.26 12.76 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.393 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.773 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 48.6 mt -61.75 -39.22 90.84 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.043 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.512 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 63.4 m170 -54.54 -41.02 69.25 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.758 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -65.28 -45.88 82.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.193 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.773 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 45.4 pttt -59.65 -44.43 93.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.175 -178.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.545 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 74.1 mm-40 -68.24 -48.88 63.94 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.542 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -60.99 -44.21 97.74 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.856 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.84 -45.36 99.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.112 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.587 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.3 m170 -64.59 -34.29 77.91 Favored 'General case' 0 C--O 1.216 -0.699 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.362 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -64.65 -48.04 76.27 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.229 -0.589 . . . . 0.0 110.502 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.424 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 37.2 m-85 -63.95 -46.37 85.01 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.566 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -69.1 -45.18 70.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.837 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.587 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 71.2 t -64.79 -43.73 96.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.342 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 37.6 mt -62.7 -50.53 70.76 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.373 -179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.568 ' HG ' ' N ' ' A' ' 157' ' ' GLU . 0.3 OUTLIER -66.18 -40.67 90.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.723 -179.358 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . 0.568 ' N ' ' HG ' ' A' ' 156' ' ' LEU . 74.2 mm-40 -70.8 -30.02 66.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.038 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' THR . . . . . 0.597 ' O ' ' OG1' ' A' ' 162' ' ' THR . 6.1 m -64.99 -51.01 64.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.73 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 pp -73.83 -37.72 64.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.419 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 50.5 m -63.73 -43.71 95.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.255 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.471 ' CG ' ' N ' ' A' ' 162' ' ' THR . 8.9 ptm180 -73.16 -41.19 64.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.155 -179.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.636 ' C ' ' H ' ' A' ' 164' ' ' GLU . 14.6 p -80.04 164.6 23.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.722 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 59.24 -5.29 0.07 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.374 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.636 ' H ' ' C ' ' A' ' 162' ' ' THR . 93.0 mt-10 -146.38 24.98 1.24 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.354 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.525 ' O ' ' CG ' ' A' ' 166' ' ' HIS . 3.6 tp -55.88 132.82 19.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.378 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.525 ' CG ' ' O ' ' A' ' 165' ' ' ILE . 73.5 m80 -160.46 46.48 0.23 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.099 0.476 . . . . 0.0 109.779 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -51.11 85.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.881 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.523 ' N ' ' O ' ' A' ' 166' ' ' HIS . 89.9 m-20 -141.5 -164.9 1.87 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.47 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 18.4 m -65.99 134.06 30.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.941 0.401 . . . . 0.0 110.476 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 16.3 tt -69.65 153.92 8.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.519 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' SER . . . . . 0.564 ' O ' ' N ' ' A' ' 173' ' ' SER . 5.6 p -129.22 86.04 57.85 Favored Pre-proline 0 N--CA 1.456 -0.149 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.321 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -38.74 83.95 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 122.806 2.337 . . . . 0.0 112.146 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.564 ' N ' ' O ' ' A' ' 171' ' ' SER . 0.1 OUTLIER -108.09 116.13 31.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.632 -179.667 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -62.65 -45.64 91.9 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.329 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.512 ' O ' ' N ' ' A' ' 177' ' ' ASP . 2.6 mt -147.27 24.26 1.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.5 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.515 ' O ' ' OD1' ' A' ' 177' ' ' ASP . 4.3 m 43.93 17.79 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.451 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.515 ' OD1' ' O ' ' A' ' 176' ' ' SER . 3.8 p-10 45.0 44.81 8.43 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.624 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.475 ' CG2' ' H ' ' A' ' 181' ' ' SER . 2.7 mt -72.65 127.88 35.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.371 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -63.97 -42.06 97.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.593 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -90.05 -47.03 3.99 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.626 ' C ' ' H ' ' A' ' 183' ' ' LEU . 1.2 m 58.01 20.52 6.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.606 0.241 . . . . 0.0 110.465 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 50.2 t -54.13 -0.88 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.827 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.626 ' H ' ' C ' ' A' ' 181' ' ' SER . 28.4 mt -80.49 -6.76 58.66 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.967 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.623 ' HD1' ' N ' ' A' ' 185' ' ' SER . 5.4 p80 -60.22 -37.4 80.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.377 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.623 ' N ' ' HD1' ' A' ' 184' ' ' HIS . 72.5 m -61.85 -45.43 93.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.098 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.407 ' O ' HD11 ' A' ' 190' ' ' LEU . 77.6 mtp85 -63.81 -44.74 92.37 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.859 -0.337 . . . . 0.0 110.795 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -62.92 -38.68 91.97 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.984 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 58.8 m -61.27 -45.77 93.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.983 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -58.06 -42.76 86.19 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.7 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.47 ' N ' HD12 ' A' ' 190' ' ' LEU . 8.8 mp -61.78 -38.55 88.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.225 178.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.496 ' O ' ' HB3' ' A' ' 195' ' ' ARG . 97.9 mttt -67.67 -32.48 73.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.388 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 97.3 mt-10 -67.85 -50.12 58.33 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.023 0.44 . . . . 0.0 111.386 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.48 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 ptmt -71.55 -41.76 68.71 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.373 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.546 ' HG ' ' N ' ' A' ' 195' ' ' ARG . 0.3 OUTLIER -70.29 -41.72 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.841 -179.361 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.546 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 14.6 ptm180 -63.46 -39.13 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.7 -41.72 97.98 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 193' ' ' LYS . 85.2 mt -64.2 -43.32 97.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.561 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.475 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.5 m-20 -62.59 -40.86 98.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.247 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.524 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 1.3 mp0 -60.55 -39.17 86.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -62.94 -37.96 95.79 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 21.6 mt -63.19 -41.12 99.15 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.717 178.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.543 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.5 OUTLIER -64.2 -35.97 82.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.482 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.5 tmt_? -64.25 -41.15 97.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.915 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.9 mt -61.58 -40.25 94.07 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -61.69 -42.86 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.897 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.581 ' O ' ' HG2' ' A' ' 210' ' ' GLN . 73.5 mtp85 -62.7 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.676 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -62.55 -36.6 75.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.408 ' N ' HG11 ' A' ' 207' ' ' VAL . 75.4 p -77.37 -26.08 51.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.094 179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -95.05 -12.98 25.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.884 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.581 ' HG2' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -131.82 -37.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.303 -179.136 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.629 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -78.57 31.72 1.9 Allowed Glycine 0 CA--C 1.527 0.825 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.489 ' H ' ' C ' ' A' ' 210' ' ' GLN . 1.6 m-85 -59.17 -38.01 78.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.676 0.274 . . . . 0.0 111.289 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.453 ' O ' ' O ' ' A' ' 214' ' ' THR . 92.5 p -137.27 101.55 4.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.035 0.445 . . . . 0.0 110.359 -179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.541 ' CG2' ' H ' ' A' ' 215' ' ' GLU . 7.5 m 48.5 178.62 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.511 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . 0.541 ' H ' ' CG2' ' A' ' 214' ' ' THR . 73.3 mm-40 -96.3 -42.2 8.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.379 -178.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -102.58 128.38 49.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.547 -178.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.667 ' OE2' ' CD ' ' A' ' 220' ' ' GLU . 1.1 mm-40 -163.08 33.02 0.1 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.069 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -103.38 10.88 37.19 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.502 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -140.36 -25.58 0.78 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.237 -179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.667 ' CD ' ' OE2' ' A' ' 217' ' ' GLU . 10.3 mt-10 -45.91 161.54 0.26 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.88 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -71.29 111.13 3.02 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.527 2.151 . . . . 0.0 112.45 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -170.32 -84.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.845 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.572 ' CG2' ' N ' ' A' ' 224' ' ' ILE . 2.7 m -61.87 -49.74 83.01 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 CA-C-O 121.506 0.67 . . . . 0.0 110.575 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.572 ' N ' ' CG2' ' A' ' 223' ' ' VAL . 0.4 OUTLIER -67.25 -26.51 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -66.99 -42.48 84.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.417 0.627 . . . . 0.0 109.318 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.0 tp -61.08 -42.05 97.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.171 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 48.2 m0 -60.62 -37.76 82.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.848 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -60.7 -39.47 88.66 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.455 ' O ' ' N ' ' A' ' 233' ' ' ALA . 92.8 mt -62.44 -42.25 99.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.947 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -41.19 -32.44 0.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.855 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -68.95 -67.83 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.657 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 91.0 p -66.23 -18.87 65.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.495 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . 0.455 ' N ' ' O ' ' A' ' 229' ' ' LEU . . . -55.25 -106.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.653 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -155.83 105.03 2.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 70.9 mt -146.68 168.59 20.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.715 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 69.4 p -80.12 164.43 23.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -63.39 -49.4 73.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.99 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.18 -44.84 94.29 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.566 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -62.95 -36.18 82.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.027 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . 0.444 HD12 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.33 -44.05 96.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.985 0.422 . . . . 0.0 110.44 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.64 -55.02 30.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.506 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.36 77.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.065 0.46 . . . . 0.0 110.402 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.418 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.04 -43.8 98.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.283 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -54.14 -54.21 42.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.045 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -62.54 -39.08 92.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.282 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -56.86 -51.96 67.01 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.233 0.54 . . . . 0.0 110.45 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.563 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.2 mm? -63.42 -36.86 85.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.772 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.439 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 88.7 tttt -55.94 -48.46 75.7 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.303 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -66.64 -39.56 88.32 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -62.28 -48.96 77.6 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.005 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.6 pt-20 -61.47 -35.07 76.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.231 0.538 . . . . 0.0 109.644 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.05 83.06 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.282 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -61.03 -46.59 90.09 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.725 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.505 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.5 tp -63.67 -37.09 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.218 -0.447 . . . . 0.0 109.891 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -56.61 -51.43 68.67 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.036 0.446 . . . . 0.0 109.87 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -61.99 -42.65 99.38 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -55.37 -44.31 75.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.199 0.523 . . . . 0.0 110.199 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -62.12 -40.15 94.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.024 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -57.8 -46.33 84.8 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.117 0.484 . . . . 0.0 110.514 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -63.69 -36.36 83.59 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.483 HE21 ' CG2' ' A' ' 297' ' ' THR . 75.3 mm-40 -58.88 -48.33 81.8 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.03 -44.88 94.33 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -63.34 -37.54 87.68 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.082 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.74 -41.86 97.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.37 -48.13 82.66 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.39 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 63.6 mt -62.15 -42.82 96.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.333 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.65 -36.91 82.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.349 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -63.34 -46.41 86.69 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.091 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.28 -45.72 92.35 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.135 0.493 . . . . 0.0 110.604 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.66 -37.77 85.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.42 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.22 -43.8 98.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.23 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -61.33 -43.24 99.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.309 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . 0.516 ' O ' ' OG ' ' A' ' 276' ' ' SER . 78.2 m80 -69.49 -40.15 77.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.756 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . 0.449 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -62.6 -38.3 89.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.4 -24.43 67.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.667 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 276' ' ' SER . . . . . 0.516 ' OG ' ' O ' ' A' ' 273' ' ' HIS . 78.7 p -78.59 -5.84 53.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.637 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.449 ' CG1' ' O ' ' A' ' 274' ' ' ALA . 10.6 p -60.1 -30.13 45.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.444 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 102.42 -72.04 0.32 Allowed Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -65.01 139.09 58.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.779 0.324 . . . . 0.0 110.544 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -92.01 126.77 8.64 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -166.11 -78.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.821 0.343 . . . . 0.0 110.482 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -72.75 -6.63 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 54.7 t -64.2 -45.17 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.533 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 1.1 p -62.2 -44.87 95.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.848 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -62.15 -44.28 96.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 t -60.86 -45.39 94.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.537 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -63.57 -35.29 80.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.417 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -60.8 -61.95 2.21 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.23 0.538 . . . . 0.0 110.363 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 11.4 mmtm -62.01 -35.4 78.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.116 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -51.27 -48.42 62.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.879 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.07 76.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 17.0 tp -62.06 -52.4 64.06 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.55 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . 0.425 ' N ' HD12 ' A' ' 293' ' ' LEU . 8.8 mp -63.47 -42.59 98.59 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.196 0.522 . . . . 0.0 110.097 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.598 ' O ' ' OG1' ' A' ' 297' ' ' THR . 83.2 tt0 -63.28 -36.37 83.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.817 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.21 -44.13 97.54 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -60.12 -43.11 95.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.468 . . . . 0.0 110.176 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.598 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 19.9 p -58.34 -43.36 88.24 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -39.85 95.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.358 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -58.41 -49.2 78.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.329 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.35 -43.55 96.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.512 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.27 -42.57 82.87 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -63.65 -47.14 82.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.054 0.454 . . . . 0.0 110.655 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 303' ' ' THR . . . . . 0.402 HG23 ' ND1' ' A' ' 307' ' ' HIS . 10.8 m -61.5 -43.78 98.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.723 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.39 -41.82 88.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -60.19 -50.38 73.89 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-O 121.153 0.501 . . . . 0.0 110.535 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -63.04 -39.98 96.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.459 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.402 ' ND1' HG23 ' A' ' 303' ' ' THR . 3.4 m170 -66.69 -33.65 76.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.997 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 3.9 mt -61.81 -46.12 90.89 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.661 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -68.31 -41.89 80.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.52 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.07 -47.17 84.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.886 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 26.8 mt -62.05 -43.2 99.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.964 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 78.4 p -62.74 -36.63 83.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.511 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.27 -45.04 83.84 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.485 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.85 -43.0 97.44 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.029 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . 0.45 HD12 HG23 ' A' ' 315' ' ' ILE . 55.8 mt -86.55 -2.62 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.739 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 46.9 t -59.15 -44.3 92.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.299 0.571 . . . . 0.0 109.464 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.508 ' CG ' ' N ' ' A' ' 318' ' ' ALA . 10.5 ptp85 -106.83 -42.72 4.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.233 -0.894 . . . . 0.0 108.866 178.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.508 ' N ' ' CG ' ' A' ' 317' ' ' ARG . . . 53.82 102.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.466 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 52.6 mmm-85 -73.37 159.8 32.76 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.078 -1.419 . . . . 0.0 111.899 -178.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -96.12 23.98 6.04 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.356 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.525 ' O ' ' O ' ' A' ' 322' ' ' GLU . 82.2 m-20 -155.1 46.27 0.51 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.134 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 321' ' ' ASN . 79.9 tt0 52.86 154.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.805 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 1.5 mp . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.726 -179.491 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 50.2 p90 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.2 m -159.62 -124.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.506 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.4 mtm-85 57.47 -172.93 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.285 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -123.51 122.18 37.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.526 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -109.49 141.21 42.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.27 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -111.93 11.19 20.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.422 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 51.23 79.34 0.35 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.485 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.34 143.9 99.5 Favored 'Trans proline' 0 N--CA 1.497 1.71 0 C-N-CA 122.618 2.212 . . . . 0.0 112.217 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.76 161.56 29.82 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.65 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.433 ' O ' ' C ' ' A' ' 11' ' ' SER . 34.3 Cg_endo -65.03 -83.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 122.709 2.273 . . . . 0.0 112.255 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 10' ' ' PRO . 43.0 t 36.05 64.38 2.31 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.531 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.03 141.61 64.84 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.633 2.222 . . . . 0.0 111.997 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -175.29 85.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.516 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 15' ' ' GLU . 86.2 mtm180 -134.88 -29.47 1.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.564 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.491 ' O ' ' O ' ' A' ' 16' ' ' SER . 96.2 mt-10 56.59 116.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.68 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' O ' ' A' ' 15' ' ' GLU . 96.1 p 50.77 168.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.752 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 158.96 -170.32 35.36 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -129.01 143.68 50.95 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.823 0.344 . . . . 0.0 110.411 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.473 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 56.1 mp0 -68.39 -43.57 77.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.912 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -123.13 173.38 7.91 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.69 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.513 ' C ' ' SD ' ' A' ' 22' ' ' MET . 87.7 mtm180 -93.8 8.61 40.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.734 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.513 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -136.21 133.88 37.55 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.263 0.554 . . . . 0.0 110.711 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.495 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 58.4 mp0 -65.72 -35.91 82.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.594 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.407 ' O ' HD22 ' A' ' 28' ' ' LEU . 64.8 mttp -58.65 -49.38 77.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.102 0.477 . . . . 0.0 110.506 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.89 -34.85 78.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.756 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -66.36 -40.67 89.93 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.54 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -62.97 -45.97 89.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.596 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.4 mm? -61.88 -41.55 98.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.562 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.425 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 55.6 t-105 -62.29 -45.94 91.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.12 0.486 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.62 -45.26 89.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.694 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.24 -41.65 97.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.478 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.34 -41.7 97.48 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.746 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 99.2 mt-30 -61.89 -39.29 91.43 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.076 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.475 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 85.5 mmt-85 -64.47 -38.99 92.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.601 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.7 -39.18 93.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.752 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.746 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 28.6 m80 66.21 106.58 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.818 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.448 ' CD2' ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -132.21 155.8 80.86 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.51 179.844 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -42.31 153.38 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.545 2.163 . . . . 0.0 112.364 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -59.3 -40.54 67.34 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.734 2.29 . . . . 0.0 112.23 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 79.1 t -62.07 -47.08 94.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.548 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttm-85 -65.8 -42.13 91.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.539 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.5 tp -63.6 -45.16 91.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.69 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.77 -46.68 86.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.55 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -66.63 -42.52 86.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.421 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.401 ' O ' ' CD1' ' A' ' 49' ' ' LEU . 59.0 tp -63.53 -51.2 66.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.848 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -58.07 -41.96 84.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.481 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.555 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.84 -47.31 86.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.544 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -56.18 -47.36 78.46 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.458 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.401 ' CD1' ' O ' ' A' ' 45' ' ' LEU . 6.9 mp -59.63 -40.29 87.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.035 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -58.85 -38.36 78.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 47' ' ' ALA . 28.3 mm -63.66 -42.52 96.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.785 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -57.72 -47.2 83.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.542 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -59.8 -50.51 73.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.26 0.552 . . . . 0.0 110.227 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 54' ' ' ARG . 71.3 mmt-85 -62.03 -41.0 97.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.564 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.413 ' O ' ' OD1' ' A' ' 55' ' ' ASP . 66.5 t0 -62.7 -39.28 93.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.543 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -60.03 -47.69 84.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.989 0.423 . . . . 0.0 110.152 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.75 -41.24 97.42 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.366 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.39 98.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.47 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.553 ' NE1' ' OD2' ' A' ' 68' ' ' ASP . 86.5 t90 -60.77 -41.28 95.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.343 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -61.3 -46.93 88.25 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -62.62 -43.14 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.406 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.5 mt -62.18 -41.49 98.37 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.146 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.464 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 88.6 tttt -60.69 -42.05 96.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.93 -40.37 95.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -64.75 -35.98 82.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.985 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.67 58.19 0.9 Allowed Glycine 0 CA--C 1.523 0.571 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 88.6 mt -125.11 -32.38 3.0 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.685 0.279 . . . . 0.0 110.656 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.553 ' OD2' ' NE1' ' A' ' 59' ' ' TRP . 46.1 t0 -91.81 115.3 27.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.365 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -134.5 -36.37 0.87 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.459 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -65.47 -34.39 78.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.413 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.462 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 89.26 14.96 59.55 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 111.014 -0.835 . . . . 0.0 111.014 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -68.61 -34.87 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.761 0.315 . . . . 0.0 110.592 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -60.63 -60.74 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.967 0.413 . . . . 0.0 110.251 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 18.0 pt-20 -56.36 -42.09 77.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.135 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.449 ' HB1' HH12 ' A' ' 79' ' ' ARG . . . -60.25 -40.7 91.25 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.265 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -61.3 -40.83 95.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -63.5 -43.36 97.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.128 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.423 HD12 HG23 ' A' ' 78' ' ' ILE . 96.6 mt -62.79 -48.73 86.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.745 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.449 HH12 ' HB1' ' A' ' 75' ' ' ALA . 94.8 mtm-85 -60.91 -40.41 93.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.086 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.455 ' O ' HG13 ' A' ' 84' ' ' ILE . 7.2 t-20 -63.41 -37.98 89.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.375 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.434 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.7 -47.53 84.21 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.189 0.519 . . . . 0.0 109.847 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -65.45 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.616 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.79 -45.54 98.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.356 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.65 -48.39 87.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.268 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 85' ' ' LEU . 3.2 mm? -64.95 -41.03 95.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.965 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.23 98.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.655 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -62.54 -48.06 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.538 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -69.07 -23.44 64.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.295 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.25 22.55 75.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.5 mt -87.94 5.76 39.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.776 0.322 . . . . 0.0 110.484 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 42.5 p-10 -80.13 4.45 17.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.353 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -49.53 162.55 0.7 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.7 ptpt -142.3 154.39 44.67 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.811 0.338 . . . . 0.0 110.709 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -171.78 46.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.609 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 49.1 96.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.866 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.56 -60.13 4.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.662 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -145.75 -37.45 0.26 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.698 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? 62.92 117.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.586 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.17 158.1 41.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.57 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.439 ' O ' ' C ' ' A' ' 101' ' ' SER . 13.5 p -110.23 -20.49 12.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.714 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.439 ' C ' ' O ' ' A' ' 100' ' ' THR . 9.2 m 36.49 59.83 0.95 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.613 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -105.35 11.83 32.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.627 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.7 m -74.31 -8.08 55.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.613 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.418 ' N ' ' CD1' ' A' ' 104' ' ' LEU . 10.5 mp -86.72 -171.89 3.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.341 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 52.6 m 58.89 105.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.626 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -130.69 89.82 0.29 Allowed Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.412 ' O ' ' N ' ' A' ' 109' ' ' GLU . 54.8 p -64.6 -32.8 74.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.791 0.329 . . . . 0.0 110.462 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -47.74 95.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.5 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 107' ' ' THR . 95.5 mt-10 -138.79 118.17 12.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.558 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.49 ' C ' ' H ' ' A' ' 112' ' ' LEU . 96.7 m-20 -126.95 -42.29 1.75 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.53 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 70.3 -43.0 0.54 Allowed Glycine 0 CA--C 1.524 0.622 0 N-CA-C 110.754 -0.938 . . . . 0.0 110.754 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.49 ' H ' ' C ' ' A' ' 110' ' ' ASP . 9.8 tp -166.09 -85.51 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.623 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.631 ' OD1' ' N ' ' A' ' 114' ' ' ASP . 9.6 p30 176.9 -79.3 0.0 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.56 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.631 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 1.5 m-20 -59.35 135.57 88.58 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.312 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 40.2 Cg_endo -68.47 -23.97 36.92 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.599 2.199 . . . . 0.0 111.911 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -70.11 -46.27 65.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.886 0.374 . . . . 0.0 110.9 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 8.3 mp -72.3 -37.44 68.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.769 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.577 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.9 mt-10 -58.95 -33.31 70.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.478 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 66.6 mttm -61.25 -48.1 82.99 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.639 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 35.5 mt -66.75 -44.16 82.2 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.773 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.47 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 6.8 t-105 -59.22 -50.3 74.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.483 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.577 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.0 m-70 -67.8 -32.2 72.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.266 179.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 127' ' ' SER . 10.8 tptt -56.94 -51.45 69.12 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.82 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.453 ' O ' ' OG ' ' A' ' 127' ' ' SER . . . -69.82 -47.03 64.31 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.554 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -53.86 -50.23 66.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.482 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -73.95 -42.83 59.94 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.484 ' HB3' ' O ' ' A' ' 123' ' ' LYS . 80.0 p -44.38 -29.58 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.01 0.433 . . . . 0.0 109.917 -178.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -161.4 -96.74 0.11 Allowed Glycine 0 N--CA 1.463 0.44 0 C-N-CA 119.848 -1.168 . . . . 0.0 111.581 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.787 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -154.91 22.75 0.44 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.445 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.2 m-30 -56.36 49.13 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.644 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.787 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -105.82 121.14 43.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.215 -179.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 114.63 -97.08 0.8 Allowed Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.211 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -77.33 -43.93 31.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.784 0.326 . . . . 0.0 110.989 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.445 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 58.5 mp0 -61.64 -51.74 67.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.018 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.435 HD23 ' CE3' ' A' ' 121' ' ' TRP . 1.1 mt -62.14 -40.86 97.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.261 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.69 -43.31 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -60.53 -42.57 96.76 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-O 121.199 0.523 . . . . 0.0 110.138 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mt -58.32 -43.52 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -66.81 -35.24 79.62 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.934 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -54.05 -41.4 68.08 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.076 -1.049 . . . . 0.0 108.227 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -71.45 -41.73 69.08 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.753 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -59.39 -57.7 11.83 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.66 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 95.8 mt -60.16 -38.98 84.82 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.206 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -54.99 -46.14 75.1 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.028 -0.669 . . . . 0.0 109.54 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -60.88 -40.01 91.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.681 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.88 -44.47 97.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.456 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -70.18 -46.4 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.388 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.37 -47.04 85.92 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.05 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 37.3 t -64.56 -41.74 93.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.71 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.591 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -58.17 -44.31 87.9 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.327 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.56 -40.03 95.94 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.98 -50.28 69.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.954 0.406 . . . . 0.0 110.575 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -72.2 -43.75 64.03 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.591 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 78.9 t -60.3 -46.71 94.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.943 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.52 -42.5 95.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.708 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.645 ' O ' ' OG ' ' A' ' 160' ' ' SER . 31.5 mt -63.21 -43.75 97.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.63 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -65.84 -31.3 72.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.198 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 72.4 m -67.29 -49.09 65.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.952 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.588 ' O ' ' O ' ' A' ' 162' ' ' THR . 3.9 pp -79.56 -20.29 47.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.705 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.645 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 73.4 m -60.76 -44.94 96.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.622 -179.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -62.17 -50.07 73.3 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.12 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.722 ' C ' ' H ' ' A' ' 164' ' ' GLU . 8.0 p -95.99 173.14 7.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.524 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 61.98 -20.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.02 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.722 ' H ' ' C ' ' A' ' 162' ' ' THR . 4.4 tp10 -113.98 22.69 13.67 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.867 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 8.4 tp -58.37 136.07 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.507 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.509 ' CD2' ' H ' ' A' ' 166' ' ' HIS . 0.3 OUTLIER -136.8 91.17 2.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.576 179.488 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.416 ' O ' ' CD ' ' A' ' 167' ' ' GLU . 3.0 pp20? -157.24 24.96 0.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.663 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -174.64 3.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.74 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 4.1 m -126.08 132.74 70.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.826 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . 0.453 ' CG2' ' O ' ' A' ' 170' ' ' ILE . 19.2 tt -174.57 108.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.656 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 1.3 p -145.53 154.86 53.15 Favored Pre-proline 0 N--CA 1.454 -0.231 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.342 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -72.5 84.0 1.23 Allowed 'Trans proline' 0 C--N 1.306 -1.681 0 C-N-CA 122.648 2.232 . . . . 0.0 112.05 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 4.0 m -133.55 148.64 51.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.7 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -68.86 -23.13 64.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.296 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.651 ' O ' ' N ' ' A' ' 177' ' ' ASP . 0.5 OUTLIER -178.66 70.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.246 179.809 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 1.6 m 58.43 -68.01 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.356 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.651 ' N ' ' O ' ' A' ' 175' ' ' LEU . 35.6 p-10 -173.19 122.54 0.38 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.628 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 28.4 mm -96.03 25.57 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.739 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -66.52 -37.9 86.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.357 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 172.25 80.84 0.05 OUTLIER Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.701 ' C ' ' H ' ' A' ' 183' ' ' LEU . 49.1 p -127.92 112.89 15.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.959 0.409 . . . . 0.0 110.477 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.95 10.56 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.151 0.501 . . . . 0.0 110.576 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.701 ' H ' ' C ' ' A' ' 181' ' ' SER . 50.2 tp -59.9 -40.38 88.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.533 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.627 ' ND1' ' N ' ' A' ' 185' ' ' SER . 14.8 p80 -47.44 -45.75 25.96 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.082 0.467 . . . . 0.0 110.406 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.627 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 45.9 t -59.85 -42.23 93.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.895 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -58.56 -44.42 89.71 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.713 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -62.89 -40.83 98.73 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.126 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.2 m -61.71 -43.48 98.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.934 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -61.27 -39.8 91.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.037 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.533 ' CD2' ' HZ1' ' A' ' 193' ' ' LYS . 5.4 mt -62.91 -46.21 88.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -69.69 -42.14 74.51 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.281 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -68.83 -43.01 76.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.565 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.552 ' O ' ' OG ' ' A' ' 196' ' ' SER . 20.5 pttt -74.24 -44.15 54.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.508 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.523 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.36 -41.69 80.28 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.875 -179.629 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.521 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.1 ptm180 -66.24 -37.31 85.2 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.552 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 91.9 p -59.09 -40.0 83.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.64 -43.57 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.251 178.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -63.37 -41.02 98.8 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.636 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.44 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 95.8 mt-30 -61.11 -40.45 93.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.456 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.09 -41.26 97.99 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 19.7 mt -62.4 -41.09 98.4 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.059 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.585 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.3 OUTLIER -63.27 -36.05 82.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.541 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.5 tmm_? -63.46 -42.61 98.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.538 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 40.6 mt -62.15 -40.08 94.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.293 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.523 ' O ' ' ND1' ' A' ' 209' ' ' HIS . 74.4 mtp85 -62.39 -42.67 99.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.086 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.754 ' O ' ' N ' ' A' ' 210' ' ' GLN . 85.2 mtm180 -64.72 -39.32 93.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.183 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.528 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 41.3 t -64.75 -44.32 96.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.105 0.479 . . . . 0.0 110.521 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.6 m -73.93 -26.7 60.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.484 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . 0.523 ' ND1' ' O ' ' A' ' 205' ' ' ARG . 57.0 m80 -100.57 -26.18 13.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.176 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.754 ' N ' ' O ' ' A' ' 206' ' ' ARG . 7.2 tp-100 -119.7 -29.62 4.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.881 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.528 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . -77.48 39.44 1.71 Allowed Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.435 ' H ' ' C ' ' A' ' 210' ' ' GLN . 70.2 t80 -107.84 145.94 32.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.737 0.303 . . . . 0.0 110.639 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.4 ' O ' ' CG2' ' A' ' 214' ' ' THR . 36.5 t -64.51 139.17 58.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.602 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' A' ' 213' ' ' SER . 23.3 p -157.22 79.83 0.9 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.454 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -174.93 43.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.743 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -172.87 152.02 2.34 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.644 ' O ' ' CD2' ' A' ' 218' ' ' PHE . 55.1 mp0 -136.31 -16.91 1.59 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.845 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.644 ' CD2' ' O ' ' A' ' 217' ' ' GLU . 2.3 m-85 176.38 -15.74 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.748 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.546 ' O ' ' C ' ' A' ' 220' ' ' GLU . 84.2 tt0 -66.3 -46.69 76.09 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.042 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.546 ' C ' ' O ' ' A' ' 219' ' ' GLU . 23.7 tt0 27.06 94.3 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.609 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -47.96 82.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.471 2.114 . . . . 0.0 112.132 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 220' ' ' GLU . 56.8 ttm-85 -162.24 -50.9 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.585 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.437 HG21 ' H ' ' A' ' 224' ' ' ILE . 0.0 OUTLIER -64.59 -71.96 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.607 0 CA-C-O 121.328 0.585 . . . . 0.0 110.832 -179.684 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.437 ' H ' HG21 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -60.01 -25.58 33.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.342 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.14 -43.97 85.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.35 0.595 . . . . 0.0 109.64 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.41 -41.97 97.98 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -61.71 -36.66 81.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.798 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.63 -37.45 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.214 0.531 . . . . 0.0 109.745 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.682 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.0 mt -64.39 -41.49 96.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.82 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 235' ' ' LEU . . . -58.54 10.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.868 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.682 ' H ' ' C ' ' A' ' 229' ' ' LEU . 2.8 pt20 -76.78 -47.44 21.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.703 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.43 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 76.8 p -129.66 9.52 5.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.644 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 234' ' ' ASN . . . -56.58 -49.6 74.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.578 -179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 233' ' ' ALA . 29.7 t30 173.66 74.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.636 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . 0.493 HD12 ' N ' ' A' ' 235' ' ' LEU . 0.7 OUTLIER -136.05 172.64 12.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 -179.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 43.2 p -94.07 167.02 11.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.72 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -62.52 -48.38 79.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.064 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.95 -45.0 95.58 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.43 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -62.5 -34.9 77.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.634 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -41.51 99.31 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.534 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -63.85 -51.42 64.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.69 98.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.1 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -64.04 -43.14 96.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.91 178.838 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -57.3 -51.19 70.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.358 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -66.51 -40.37 89.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.585 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -59.36 -51.04 71.65 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.402 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.464 HD22 ' O ' ' A' ' 243' ' ' PHE . 4.3 mm? -64.29 -37.04 86.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.563 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.669 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 33.6 ttpt -56.46 -43.8 79.92 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.192 0.52 . . . . 0.0 110.184 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -69.58 -42.71 74.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.488 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -61.93 -48.74 79.05 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.21 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.669 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 2.5 pp20? -60.27 -38.33 83.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.134 0.492 . . . . 0.0 109.905 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 251' ' ' GLU . . . -66.64 -36.59 82.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.366 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.23 -47.61 83.67 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.174 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.457 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.7 OUTLIER -65.1 -41.91 93.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.592 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -61.4 -46.73 88.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.319 0.58 . . . . 0.0 110.112 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.57 -41.72 98.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.332 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -55.02 -45.44 75.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.124 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -61.3 -42.94 99.5 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.15 0.5 . . . . 0.0 110.19 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.4 -41.18 96.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.166 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . 0.425 ' O ' ' N ' ' A' ' 264' ' ' LEU . 26.0 m-85 -63.65 -37.29 86.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.522 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.481 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 35.3 mm-40 -60.3 -52.02 67.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.229 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.69 -45.31 94.66 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.081 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -67.37 -30.44 70.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.277 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' A' ' 260' ' ' TYR . 46.4 tp -63.52 -45.4 90.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.047 0.451 . . . . 0.0 110.308 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.37 -47.63 69.84 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.519 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 97.6 mt -62.42 -43.06 97.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.943 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.056 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -59.56 -46.94 87.43 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.08 0.466 . . . . 0.0 110.193 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -62.6 -43.82 97.85 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.278 0.561 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.08 -39.51 90.18 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.327 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . 0.463 ' C ' ' CD2' ' A' ' 271' ' ' LEU . 7.4 tt -59.85 -43.83 94.44 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.3 ttt85 -58.45 -44.46 89.24 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.126 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -68.52 -40.2 80.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.567 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . 0.417 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -57.24 -44.21 83.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.692 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . 0.553 ' OE2' ' NH2' ' A' ' 287' ' ' ARG . 92.2 mt-10 -61.66 -22.28 65.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.494 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.5 t -91.85 5.84 48.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.626 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.424 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 14.5 p -62.44 -43.66 98.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.61 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.424 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 166.41 -111.83 0.47 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -61.53 -41.01 96.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.78 0.324 . . . . 0.0 110.563 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 281' ' ' GLU . . . 152.72 -111.69 0.5 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . 0.657 ' C ' ' H ' ' A' ' 283' ' ' VAL . 95.5 mt-10 58.9 152.66 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 281' ' ' GLU . 96.8 mtt180 64.26 -19.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . 0.657 ' H ' ' C ' ' A' ' 281' ' ' GLU . 8.9 p -67.91 -47.42 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.696 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 284' ' ' SER . . . . . 0.424 ' N ' ' CG1' ' A' ' 283' ' ' VAL . 42.1 m -63.41 -44.94 93.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.941 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -65.73 -43.53 88.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.833 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 59.1 m -61.11 -44.98 96.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.794 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . 0.553 ' NH2' ' OE2' ' A' ' 275' ' ' GLU . 94.8 mtt-85 -66.03 -39.61 90.34 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.189 0.519 . . . . 0.0 111.045 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.97 -59.21 5.82 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.073 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . 0.4 ' HA ' ' HB3' ' A' ' 292' ' ' LEU . 54.6 mmtt -63.41 -39.88 95.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.07 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -41.81 -57.78 2.24 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.382 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.37 80.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.717 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . 0.4 ' HB3' ' HA ' ' A' ' 289' ' ' LYS . 35.6 tp -60.65 -49.87 75.77 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.499 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . 0.444 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.8 mp -64.93 -41.63 95.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.978 0.418 . . . . 0.0 110.06 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -58.93 -45.35 90.59 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.182 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.28 -43.83 98.54 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -62.72 -38.87 92.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.419 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.481 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 1.5 m -60.75 -51.71 68.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.395 0.617 . . . . 0.0 110.076 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -65.3 -44.95 86.27 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.246 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -58.39 -38.01 76.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.987 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.72 -42.82 99.85 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.66 -46.19 93.68 Favored Glycine 0 CA--C 1.53 1.009 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.62 -43.51 93.75 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 110.45 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.8 m -60.26 -41.64 93.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.128 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.83 -43.86 89.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -57.6 -55.11 39.07 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.244 0.545 . . . . 0.0 110.619 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -62.73 -38.47 90.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.425 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -63.35 -38.01 89.51 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.279 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 6.8 mt -62.02 -44.56 96.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.343 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? -70.59 -43.2 69.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.704 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -63.34 -46.02 88.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.836 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 23.9 mt -63.43 -42.11 98.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.92 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 67.8 m -58.97 -44.29 91.5 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.362 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -71.04 -36.64 64.35 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -63.2 -43.89 96.91 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.732 0.301 . . . . 0.0 110.758 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . 0.591 ' O ' ' N ' ' A' ' 317' ' ' ARG . 2.3 mt -81.29 -97.16 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.904 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 315' ' ' ILE . 0.4 OUTLIER 35.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.095 0.474 . . . . 0.0 110.444 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.591 ' N ' ' O ' ' A' ' 315' ' ' ILE . 17.6 ptp180 -70.33 -36.95 74.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.465 -178.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.508 ' N ' ' O ' ' A' ' 315' ' ' ILE . . . 50.83 91.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.555 ' HE ' ' HD3' ' A' ' 317' ' ' ARG . 18.0 mmt85 -69.98 160.99 30.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.982 -178.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . 0.463 ' CG ' ' N ' ' A' ' 321' ' ' ASN . 47.0 p-80 -56.44 -42.88 78.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.417 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.463 ' N ' ' CG ' ' A' ' 320' ' ' HIS . 95.9 m-20 -96.64 148.96 22.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.768 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -48.37 128.35 14.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.25 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.411 HD11 ' H ' ' A' ' 323' ' ' LEU . 2.7 mp . . . . . 0 C--O 1.219 -0.511 0 CA-C-O 118.088 -0.958 . . . . 0.0 110.636 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.5 m -72.38 146.93 46.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.307 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.486 ' O ' ' O ' ' A' ' 4' ' ' GLU . 56.7 ttt180 -129.49 99.15 5.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.36 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 3' ' ' ARG . 83.2 tt0 33.47 97.15 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.121 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -66.79 131.46 45.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.469 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -135.71 -89.82 0.31 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.535 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -150.87 153.32 33.24 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.373 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.14 156.22 29.79 Favored 'Trans proline' 0 N--CA 1.498 1.742 0 C-N-CA 123.063 2.509 . . . . 0.0 112.595 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.6 ' H ' ' HD2' ' A' ' 10' ' ' PRO . 3.7 tmtt? -156.75 -50.99 0.01 OUTLIER Pre-proline 0 N--CA 1.469 0.51 0 CA-C-N 116.746 -0.207 . . . . 0.0 111.46 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.6 ' HD2' ' H ' ' A' ' 9' ' ' LYS . 41.9 Cg_endo -77.18 114.81 3.85 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 121.914 1.742 . . . . 0.0 112.267 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.465 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 3.5 m 178.52 51.44 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.562 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.465 ' CD ' ' N ' ' A' ' 11' ' ' SER . 38.9 Cg_endo -65.53 144.16 78.11 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.589 2.193 . . . . 0.0 111.834 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -111.84 87.76 2.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.093 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -87.4 126.53 34.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.244 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -109.97 -6.94 15.04 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.958 0.409 . . . . 0.0 110.44 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 87.0 p -75.23 161.15 29.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.63 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -145.7 -174.29 17.74 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -137.14 174.5 10.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.69 0.281 . . . . 0.0 110.415 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -65.26 -35.19 80.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.852 0.358 . . . . 0.0 110.531 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -133.83 158.77 42.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.892 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.3 mtt180 -94.4 16.45 15.14 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.901 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.581 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.5 mmt -142.29 133.9 26.75 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.113 0.482 . . . . 0.0 111.217 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -67.3 -43.99 80.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.539 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -60.01 -45.69 91.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.419 0.628 . . . . 0.0 110.5 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.3 tp -60.76 -38.77 86.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.402 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.581 ' ND2' ' O ' ' A' ' 22' ' ' MET . 49.6 m-80 -62.37 -39.29 92.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.814 179.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -57.59 -46.25 84.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.258 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -61.42 -43.2 99.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.095 0.474 . . . . 0.0 110.41 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.404 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 24.8 t-105 -60.91 -45.41 94.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.235 0.54 . . . . 0.0 110.595 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.41 -40.61 87.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.264 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -60.57 -43.3 97.44 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.255 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.99 97.17 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.284 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.541 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 77.3 mt-30 -58.16 -45.07 88.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.344 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.486 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 93.7 mtm-85 -65.65 -33.98 77.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.48 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.3 tp -62.09 -37.57 85.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.127 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.541 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 26.8 m80 65.94 109.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 mt -139.3 154.96 72.4 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.02 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 154.6 0.1 OUTLIER 'Trans proline' 0 C--N 1.312 -1.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.26 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.14 -34.7 16.02 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.461 2.108 . . . . 0.0 112.321 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.49 -48.91 81.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.617 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -69.94 -39.97 75.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.586 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.7 -43.89 95.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.586 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.09 -44.4 84.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.612 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -66.88 -45.73 77.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.643 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.1 tp -62.67 -47.91 81.61 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.534 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -59.03 -40.71 85.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.973 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.442 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.93 -45.13 93.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.812 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.07 -46.4 85.5 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.915 0.388 . . . . 0.0 110.409 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 40.6 mt -60.01 -40.84 90.65 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.128 0.489 . . . . 0.0 110.158 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -59.0 -39.64 82.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.059 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.4 mm -62.13 -43.8 98.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.648 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -55.74 -44.83 77.95 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.389 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -60.41 -46.73 88.94 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.261 0.553 . . . . 0.0 110.425 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.62 -43.34 93.84 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.7 -38.64 85.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.115 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -58.07 -47.32 83.52 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 16.0 mt -60.84 -42.6 98.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.391 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.09 99.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.5 t90 -57.6 -43.14 84.46 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.135 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.66 -45.87 92.19 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.03 0.443 . . . . 0.0 109.931 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.09 -44.45 91.91 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.5 HD22 ' HZ3' ' A' ' 73' ' ' LYS . 7.2 mp -62.72 -39.04 92.82 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.848 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.51 -44.55 76.73 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 30.6 mt -62.2 -41.38 98.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.038 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.61 -37.45 86.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.37 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.12 33.04 5.61 Favored Glycine 0 CA--C 1.528 0.87 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.6 mt -89.04 -56.53 3.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.84 0.352 . . . . 0.0 110.786 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.504 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 10.0 p-10 -75.88 145.06 40.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -143.98 -50.74 0.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.454 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.89 -33.28 75.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.224 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.56 21.86 39.02 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -60.46 -33.97 73.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HZ3' HD22 ' A' ' 62' ' ' LEU . 98.4 mttt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.042 0.449 . . . . 0.0 110.096 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -58.07 -42.88 86.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.147 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.51 92.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.371 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -60.37 -42.73 96.42 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.62 -42.83 99.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.7 -45.52 97.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -61.58 -41.73 97.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.205 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -63.9 -38.94 92.95 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.294 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.488 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 2.9 tm? -59.54 -48.52 81.32 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.755 -0.778 . . . . 0.0 109.841 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -63.6 -38.67 92.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.639 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 78.2 t -62.81 -46.42 96.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.428 HD12 HG21 ' A' ' 84' ' ' ILE . 96.8 mt -60.32 -48.89 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.52 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.49 -40.8 93.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.4 . . . . 0.0 110.897 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.85 -47.74 83.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.68 -44.13 97.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.104 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -34.69 78.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.106 0.479 . . . . 0.0 109.954 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.46 25.9 55.76 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.822 ' O ' ' N ' ' A' ' 92' ' ' GLY . 45.9 mt -86.24 -83.29 0.18 Allowed 'General case' 0 C--O 1.231 0.107 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.513 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 32.2 t70 53.54 -53.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.807 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.822 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . 107.62 -2.71 34.28 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 44.4 tptt -66.07 133.6 51.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.79 0.329 . . . . 0.0 110.35 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.451 ' O ' ' O ' ' A' ' 95' ' ' ASP . 54.9 tptt -58.18 -76.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.495 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.537 ' CG ' ' H ' ' A' ' 96' ' ' ALA . 42.8 t0 44.94 -173.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.359 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.537 ' H ' ' CG ' ' A' ' 95' ' ' ASP . . . -152.23 151.33 30.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.739 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.546 ' O ' ' O ' ' A' ' 98' ' ' GLN . 90.5 mtm-85 -142.33 112.81 7.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.519 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.546 ' O ' ' O ' ' A' ' 97' ' ' ARG . 48.1 tt0 53.16 122.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.502 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 59.5 t -108.77 131.95 58.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.29 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.6 p -65.63 153.55 41.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.293 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.6 m -59.38 -41.98 90.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.505 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -151.56 -85.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.555 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.6 p -163.11 1.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.768 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.95 124.15 51.97 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.738 0.304 . . . . 0.0 110.467 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 86.6 p -159.0 161.94 36.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.579 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.414 ' O ' ' N ' ' A' ' 108' ' ' GLN . . . 55.33 -95.06 0.03 OUTLIER Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.8 m 67.67 -59.9 0.4 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.721 0.296 . . . . 0.0 110.818 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.414 ' N ' ' O ' ' A' ' 106' ' ' GLY . 13.6 pt20 -146.8 145.5 29.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.546 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -145.56 112.95 6.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.444 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -134.1 -85.11 0.43 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.492 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.43 -104.3 0.19 Allowed Glycine 0 CA--C 1.52 0.345 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.7 tp -134.94 -85.92 0.39 Allowed 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 121.005 -0.278 . . . . 0.0 110.929 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.3 t0 174.81 -83.04 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.531 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -52.07 113.65 4.48 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.548 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -51.19 -35.6 52.94 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.325 2.017 . . . . 0.0 112.323 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 95.5 mtm-85 -61.17 -45.01 96.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.915 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.09 -39.46 82.88 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.408 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.597 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 99.1 mt-10 -54.84 -24.65 24.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.259 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 57.0 mtpt -60.15 -49.72 76.53 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.096 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.87 -44.75 69.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.975 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.426 ' NE1' HD13 ' A' ' 135' ' ' LEU . 9.2 t-105 -59.07 -48.84 80.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.49 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.597 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.435 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.2 OUTLIER -55.91 -51.28 68.16 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.729 -178.812 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.29 -46.7 63.76 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.814 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -51.68 -51.53 55.18 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.648 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -76.68 -41.99 43.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.821 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.9 t -45.55 -27.34 0.73 Allowed 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.062 0.458 . . . . 0.0 109.912 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.12 -91.79 0.08 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.426 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' ' 131' ' ' SER . 11.8 ptmt -165.62 31.03 0.05 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -65.13 43.4 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.341 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.56 ' H ' ' C ' ' A' ' 129' ' ' LYS . 6.7 m -98.36 123.54 42.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.651 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 112.7 -97.29 0.88 Allowed Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.076 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -78.61 -43.24 26.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.749 0.309 . . . . 0.0 111.246 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -60.97 -51.97 66.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 0.0 110.142 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.426 HD13 ' NE1' ' A' ' 121' ' ' TRP . 2.2 mt -62.43 -42.89 99.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.035 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.21 -39.95 92.15 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 2.9 mmpt? -61.49 -42.1 98.28 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.281 0.562 . . . . 0.0 109.869 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mt -58.05 -43.39 86.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -36.15 82.74 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 176.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.507 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 6.5 mpt_? -54.12 -42.95 70.03 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.522 ' OE1' ' O ' ' A' ' 137' ' ' LYS . 5.6 mp0 -70.09 -41.86 73.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.825 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -61.06 -53.73 53.52 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.693 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 98.9 mt -59.92 -40.71 89.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.097 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' A' ' 140' ' ' ARG . 6.4 m80 -56.48 -44.28 80.48 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -63.28 -38.68 92.11 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.592 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -60.82 -43.14 98.6 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.106 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.722 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 98.1 mt-10 -69.83 -45.71 67.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.002 0.429 . . . . 0.0 111.684 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -70.65 -44.53 66.9 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.481 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.543 ' CG1' ' N ' ' A' ' 150' ' ' HIS . 4.4 p -63.44 -49.34 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.983 -178.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.722 ' CD2' ' O ' ' A' ' 147' ' ' GLU . 0.2 OUTLIER -70.51 -23.25 62.62 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.004 -179.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.682 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 24.6 mt-10 -67.18 -52.28 43.3 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.814 179.091 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -63.25 -41.53 99.07 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -63.92 -40.1 95.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.231 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.454 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 19.8 t -60.38 -47.65 91.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.042 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.44 -43.76 93.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.844 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.512 ' O ' ' OG ' ' A' ' 160' ' ' SER . 19.7 mt -63.31 -42.3 99.01 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.647 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -65.07 -33.88 77.08 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.089 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 63.9 m -64.43 -49.95 69.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.823 -179.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.8 pp -78.87 -21.4 47.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.638 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.512 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 37.0 m -61.62 -32.33 72.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.869 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.429 ' C ' ' H ' ' A' ' 163' ' ' GLU . 81.0 mtp180 -53.0 -42.73 65.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.721 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.57 24.78 0.45 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.494 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.429 ' H ' ' C ' ' A' ' 161' ' ' ARG . 9.7 tm-20 -117.1 -27.6 6.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.994 179.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -103.17 61.49 0.78 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.941 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.5 ' CG2' ' O ' ' A' ' 165' ' ' ILE . 1.4 tt -134.46 103.67 4.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.483 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 29.3 m170 44.63 32.03 0.71 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.114 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 51.4 tp10 -93.09 116.8 29.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.592 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 45.7 p30 -158.92 18.64 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.54 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 1.5 m -123.47 129.27 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.602 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.6 tt -158.92 147.51 7.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.665 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -135.53 164.43 43.6 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.453 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.39 -30.94 65.73 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.814 2.342 . . . . 0.0 112.061 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.554 ' C ' ' H ' ' A' ' 175' ' ' LEU . 8.4 m -55.18 -14.79 1.83 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.678 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 13.5 t70 65.54 -41.9 0.34 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.579 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.554 ' H ' ' C ' ' A' ' 173' ' ' SER . 6.4 tp -162.72 46.95 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.427 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.507 ' O ' ' O ' ' A' ' 177' ' ' ASP . 12.8 t 49.07 67.12 0.93 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.479 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.507 ' O ' ' O ' ' A' ' 176' ' ' SER . 65.7 t0 56.05 124.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.806 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 96.3 mt -121.03 130.38 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.175 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.622 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -128.96 12.3 6.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.582 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 136.14 93.71 0.39 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.719 ' C ' ' H ' ' A' ' 183' ' ' LEU . 82.7 p -121.68 15.04 11.02 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.548 0.213 . . . . 0.0 110.604 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.442 ' O ' ' CG1' ' A' ' 182' ' ' VAL . 20.4 t 55.76 -7.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.751 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.719 ' H ' ' C ' ' A' ' 181' ' ' SER . 14.2 tp -62.34 -41.12 98.33 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.282 0.563 . . . . 0.0 110.687 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -48.02 -34.23 9.11 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.309 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 47.0 t -60.27 -45.2 94.13 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.14 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.626 HH21 ' CD1' ' A' ' 183' ' ' LEU . 59.3 mtm180 -65.68 -39.42 91.29 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.544 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -66.3 -41.79 89.23 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.61 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 59.6 m -62.51 -44.61 95.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.325 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -63.48 -39.46 94.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.052 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.617 ' CD2' ' HZ3' ' A' ' 193' ' ' LYS . 5.3 mt -62.3 -46.68 87.69 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.556 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.442 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.8 mttt -68.6 -38.27 80.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.942 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -67.81 -48.21 66.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.764 -178.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.617 ' HZ3' ' CD2' ' A' ' 190' ' ' LEU . 14.3 pttt -73.2 -41.18 64.09 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.011 -179.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.509 ' HG ' ' N ' ' A' ' 195' ' ' ARG . 0.3 OUTLIER -70.52 -41.77 72.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.849 -179.4 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.509 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 12.8 ptm180 -65.72 -38.99 90.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.434 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.0 -42.29 98.16 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 193' ' ' LYS . 82.2 mt -64.42 -43.86 97.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.761 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -62.09 -41.7 98.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.504 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.29 -31.94 73.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.338 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.57 78.41 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 24.8 mt -63.22 -40.8 98.5 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.864 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.56 -39.96 93.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -41.76 99.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.497 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 31.9 mt -60.9 -40.66 93.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.449 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -62.2 -44.24 97.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.294 0.569 . . . . 0.0 109.668 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.595 ' O ' ' N ' ' A' ' 210' ' ' GLN . 24.2 mmt85 -63.73 -39.54 94.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.069 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 211' ' ' GLY . 48.5 t -62.99 -45.64 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.042 0.449 . . . . 0.0 109.897 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 15.6 m -63.39 -29.51 70.8 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.339 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.9 m170 -93.57 -46.03 7.47 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.69 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.657 ' C ' ' H ' ' A' ' 212' ' ' TYR . 2.9 pp0? -105.56 -25.57 12.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.657 0.265 . . . . 0.0 111.112 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -61.42 8.17 0.12 Allowed Glycine 0 N--CA 1.459 0.202 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.657 ' H ' ' C ' ' A' ' 210' ' ' GLN . 65.2 t80 -66.98 166.94 12.64 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.186 0.517 . . . . 0.0 111.441 -179.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.6 ' N ' ' CG ' ' A' ' 212' ' ' TYR . 16.8 p -43.31 104.13 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.201 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 1.9 p -131.86 166.47 21.52 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.37 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -91.75 164.85 13.56 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.077 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . 0.451 ' O ' ' CB ' ' A' ' 217' ' ' GLU . . . 65.1 -175.0 0.18 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.679 0.276 . . . . 0.0 110.846 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.451 ' CB ' ' O ' ' A' ' 216' ' ' ALA . 67.3 tt0 81.34 35.54 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -114.41 104.27 11.89 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -139.6 -34.61 0.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.329 -0.949 . . . . 0.0 112.698 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.97 151.24 86.31 Favored Pre-proline 0 C--O 1.235 0.325 0 C-N-CA 119.136 -1.025 . . . . 0.0 108.314 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.616 ' O ' ' N ' ' A' ' 223' ' ' VAL . 78.0 Cg_exo -38.26 -79.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.28 1.987 . . . . 0.0 112.418 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 221' ' ' PRO . 43.6 ttm180 36.09 -84.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.092 0.472 . . . . 0.0 111.402 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.616 ' N ' ' O ' ' A' ' 221' ' ' PRO . 2.1 t -59.75 -65.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.139 0.495 . . . . 0.0 110.691 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 1.1 mp -51.19 -28.03 6.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.754 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 56.6 t0 -63.51 -45.91 88.47 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 109.868 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.1 mt -61.2 -42.13 98.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.596 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . 0.42 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 44.2 m0 -61.49 -36.67 81.12 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.355 -0.538 . . . . 0.0 109.949 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.8 -40.21 94.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 231' ' ' GLN . 96.8 mt -64.02 -41.81 97.33 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.263 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -36.68 -29.39 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.999 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 229' ' ' LEU . 89.1 mt-30 -62.49 -65.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.715 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 5.4 t -87.05 14.69 7.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.688 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -80.47 -76.1 0.24 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.805 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -173.26 81.66 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.905 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 76.5 mt -141.54 149.26 40.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.615 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 70.4 p -71.3 -167.01 0.2 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.407 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . 0.472 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 27.0 p-10 -82.53 -47.82 11.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.327 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . 0.401 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 65.1 mttp -63.38 -44.33 95.03 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.081 0.467 . . . . 0.0 110.625 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . 0.458 ' HG2' ' HA ' ' A' ' 322' ' ' GLU . 93.7 mt-10 -62.3 -36.45 82.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.686 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . 0.411 ' C ' ' CD1' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.2 -45.0 93.73 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.535 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -62.08 -46.73 87.81 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.465 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -63.24 -40.85 98.6 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.06 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.526 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -65.71 -43.73 88.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.52 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . 0.401 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 0.0 OUTLIER -59.99 -48.21 82.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.009 0.433 . . . . 0.0 110.441 -178.703 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -65.19 -46.08 82.2 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.825 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -57.27 -50.17 73.76 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.071 0.462 . . . . 0.0 110.345 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.417 HD22 ' O ' ' A' ' 243' ' ' PHE . 4.0 mm? -63.97 -37.39 87.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.687 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.65 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.4 tttt -55.28 -47.63 75.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.061 0.458 . . . . 0.0 109.866 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -67.48 -43.77 80.16 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.076 -0.649 . . . . 0.0 110.989 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 29.9 t80 -60.65 -48.06 83.46 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.509 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.65 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.9 OUTLIER -61.86 -36.63 81.81 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.04 -41.6 90.66 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.826 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.45 -46.9 86.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 111.137 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -38.81 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.791 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -55.83 -48.8 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.343 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -62.24 -43.11 99.57 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.26 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -57.83 -43.1 85.6 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.131 0.491 . . . . 0.0 110.291 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -61.52 -40.97 96.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.364 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -59.18 -46.69 87.74 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 120.954 0.407 . . . . 0.0 110.285 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -62.07 -37.5 85.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.28 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.515 HE21 ' CG2' ' A' ' 297' ' ' THR . 90.0 mm-40 -61.6 -42.62 99.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.524 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 24.1 mmtp -62.0 -45.64 92.74 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.098 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -66.34 -35.99 81.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.148 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.31 -43.73 98.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.39 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.46 -45.38 83.98 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.677 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 55.9 mt -62.97 -43.27 98.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.734 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.14 -38.63 83.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.035 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.29 -47.42 86.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.407 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -58.43 -48.85 79.37 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.361 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -61.11 -37.66 83.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 4.7 tt -59.81 -44.26 94.07 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -61.35 -44.81 96.55 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.078 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.49 -44.6 82.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.863 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.03 -34.69 73.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -59.92 -35.16 74.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.962 0.411 . . . . 0.0 110.116 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 15.6 m -61.25 -31.47 71.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.834 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.34 -44.04 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.453 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 105.03 6.1 40.12 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -84.35 100.47 11.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.379 . . . . 0.0 110.127 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.3 86.87 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -55.58 -50.8 69.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.582 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -66.53 -38.28 86.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.93 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 72.5 t -60.87 -47.29 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.48 -46.4 88.65 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.054 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -62.44 -43.03 99.81 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.706 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.2 t -60.47 -45.14 94.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.459 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -64.07 -36.65 84.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.708 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.61 -58.87 6.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . 0.444 ' HZ1' HD22 ' A' ' 292' ' ' LEU . 28.5 mmtt -64.34 -33.48 75.94 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.061 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 -55.26 -48.67 73.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.443 -0.503 . . . . 0.0 109.919 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.84 -39.1 80.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.964 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . 0.444 HD22 ' HZ1' ' A' ' 289' ' ' LYS . 8.5 tp -62.28 -54.92 33.71 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.736 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 9.8 tp -62.65 -42.43 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.181 0.515 . . . . 0.0 109.958 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.488 ' O ' ' OG1' ' A' ' 297' ' ' THR . 81.7 tt0 -63.35 -36.98 85.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.993 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.47 -45.71 94.21 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -60.56 -44.03 96.63 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.056 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.515 ' CG2' HE21 ' A' ' 261' ' ' GLN . 21.9 p -59.39 -39.84 84.66 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.563 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.77 -47.47 83.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.029 0.442 . . . . 0.0 110.838 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.2 -41.29 92.67 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.092 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.953 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.44 -40.0 91.47 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -61.54 -46.7 88.82 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 110.486 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 17.7 m -60.34 -45.21 94.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.542 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.98 -42.18 91.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.854 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -56.59 -48.75 76.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.752 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -61.56 -42.89 99.5 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.185 0.517 . . . . 0.0 110.457 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -68.95 -31.09 69.71 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.311 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.94 -49.01 77.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.327 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 310' ' ' ASP . 12.5 pt20 -67.88 -42.0 81.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . 0.444 ' OD1' ' NE ' ' A' ' 314' ' ' ARG . 48.4 t0 -62.29 -51.1 69.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.995 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.45 -40.19 95.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.883 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 66.5 m -58.58 -44.79 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.64 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -70.13 -45.47 55.98 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.462 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.444 ' NE ' ' OD1' ' A' ' 310' ' ' ASP . 95.1 mtt-85 -63.44 -47.52 81.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.724 0.297 . . . . 0.0 111.23 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -65.59 -43.19 94.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.643 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.453 ' HG ' ' N ' ' A' ' 317' ' ' ARG . 78.0 p -58.51 -38.08 76.94 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.508 -0.477 . . . . 0.0 109.932 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.588 ' C ' ' H ' ' A' ' 319' ' ' ARG . 43.2 tpt85 -86.38 -50.25 7.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.775 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.487 ' O ' ' C ' ' A' ' 319' ' ' ARG . . . 52.09 6.69 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -178.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.588 ' H ' ' C ' ' A' ' 317' ' ' ARG . 96.0 mtm-85 24.76 -104.85 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.391 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -163.72 -52.11 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.264 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.649 ' O ' ' O ' ' A' ' 322' ' ' GLU . 35.2 t30 -90.81 86.75 6.41 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.373 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.649 ' O ' ' O ' ' A' ' 321' ' ' ASN . 0.9 OUTLIER 39.1 178.33 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.376 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.411 ' HA ' HH21 ' A' ' 319' ' ' ARG . 81.8 mt . . . . . 0 C--O 1.219 -0.512 0 CA-C-O 117.865 -1.064 . . . . 0.0 109.966 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 57.7 t80 . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -89.11 -3.65 58.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.821 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -72.26 142.72 48.93 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.595 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -148.59 134.38 18.92 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.6 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -150.64 138.85 20.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.401 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -175.94 138.49 0.36 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.589 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -152.64 148.34 20.55 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.286 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.74 157.6 59.86 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.994 2.463 . . . . 0.0 112.502 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -101.45 109.63 59.49 Favored Pre-proline 0 CA--C 1.533 0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.138 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.19 155.42 42.07 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 C-N-CA 122.666 2.244 . . . . 0.0 112.044 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.7 p -149.38 77.82 8.76 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.639 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -59.01 146.2 95.0 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.52 2.147 . . . . 0.0 112.032 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -121.99 146.37 47.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.362 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 71.0 ttt180 -96.22 -85.37 0.34 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.281 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 57.56 109.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.501 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.607 ' HG ' ' N ' ' A' ' 17' ' ' GLY . 29.2 t -159.75 167.75 27.54 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.751 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.607 ' N ' ' HG ' ' A' ' 16' ' ' SER . . . -168.67 -157.84 11.93 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.095 -0.802 . . . . 0.0 111.095 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 61.64 60.18 1.68 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.649 0.262 . . . . 0.0 110.365 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.74 -35.86 75.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.885 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -125.57 161.52 27.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.923 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -65.47 -34.62 78.7 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.0 mmm -124.18 149.92 45.78 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.405 0.621 . . . . 0.0 110.648 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.557 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 52.5 mp0 -61.62 -41.71 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.424 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -46.08 -57.04 4.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.173 0.511 . . . . 0.0 110.494 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.5 mt -59.79 -35.38 74.55 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.867 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -64.55 -39.35 93.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.394 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.36 -46.87 88.41 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.14 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -59.77 -41.82 91.91 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.46 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 29.1 t-105 -59.92 -43.41 94.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 0.0 110.401 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -57.9 -41.98 83.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.206 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -61.25 -41.58 97.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.39 95.17 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.324 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.473 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 76.6 mt-30 -62.39 -38.4 89.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.32 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.527 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.0 mt -65.27 -38.37 90.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.446 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.35 109.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.3 mt -134.42 154.9 80.07 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -37.91 154.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.816 2.344 . . . . 0.0 112.202 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.95 -47.02 2.73 Favored 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.736 2.29 . . . . 0.0 112.551 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.6 m -61.31 -47.18 94.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.452 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.4 ttm-85 -64.9 -40.64 95.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.434 179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.14 -43.92 97.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.58 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.69 97.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.514 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -66.19 -47.09 75.06 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.618 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.01 -47.75 85.0 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.374 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -59.24 -41.25 88.3 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.293 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.46 93.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.391 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -58.4 -45.79 87.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.137 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.1 mt -58.51 -41.49 85.53 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.178 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -59.15 -39.84 83.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.062 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mm -63.09 -43.02 98.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.858 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -56.4 -47.49 78.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.263 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -61.32 -44.36 97.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.107 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -60.02 -45.49 92.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.577 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -63.1 -37.83 88.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.655 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.0 -49.52 77.11 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.274 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.3 tp -59.44 -41.15 88.93 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.19 0.519 . . . . 0.0 110.163 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.56 -50.97 71.37 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.568 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -57.82 -38.86 76.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.423 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -57.1 -45.77 83.13 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -60.59 -48.93 79.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.178 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.573 ' C ' ' CD1' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.03 -35.65 80.93 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.025 -0.67 . . . . 0.0 109.641 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.434 ' N ' ' HG ' ' A' ' 62' ' ' LEU . 29.3 tptp -61.26 -41.26 96.62 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 34.9 tp -60.19 -43.26 96.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.734 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -66.74 -35.35 79.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.999 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.3 67.49 1.36 Allowed Glycine 0 CA--C 1.52 0.365 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.618 ' O ' ' O ' ' A' ' 68' ' ' ASP . 99.1 mt -130.54 -86.99 0.51 Allowed 'General case' 0 N--CA 1.461 0.092 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.628 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.618 ' O ' ' O ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER 53.15 141.55 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.438 179.579 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.528 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 83.5 tt0 -62.39 -51.98 65.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.868 0.366 . . . . 0.0 110.711 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 39.7 p30 -175.25 24.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.694 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.569 ' H ' ' CG ' ' A' ' 68' ' ' ASP . . . 89.34 -0.95 81.69 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -66.2 -32.67 74.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.713 0.292 . . . . 0.0 110.343 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.63 -49.45 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.268 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -62.33 -44.0 97.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.359 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.31 90.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.452 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -62.6 -42.45 99.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.911 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.5 mt -62.85 -44.57 95.77 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.057 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.65 -47.36 91.57 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.266 0.555 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -61.35 -40.89 95.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.049 179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -60.7 -41.2 94.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.373 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.422 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -60.21 -47.43 85.98 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.253 0.549 . . . . 0.0 110.049 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 28.6 t-20 -67.42 -37.53 83.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.56 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 43.5 t -62.43 -48.27 89.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.441 -179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.412 HD11 HG23 ' A' ' 84' ' ' ILE . 96.9 mt -61.44 -48.33 89.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.536 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.99 -42.19 97.26 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.85 87.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.348 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.76 -47.29 85.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.497 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -76.12 -21.14 56.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.439 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.98 27.51 70.33 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.6 mt -86.98 -1.45 57.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.662 0.267 . . . . 0.0 110.592 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.412 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 59.3 t0 -60.78 -83.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.192 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 154.93 -167.39 32.72 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.092 -0.575 . . . . 0.0 111.797 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 94' ' ' LYS . 46.7 mttt -99.79 -176.61 3.31 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 93' ' ' LYS . 52.2 mttp 57.03 120.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.766 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -154.8 166.45 33.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.527 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 44.64 92.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.622 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 60.2 mmt-85 -63.91 -44.85 91.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.851 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -179.67 -78.42 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.76 0.314 . . . . 0.0 110.638 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.421 HG13 ' H ' ' A' ' 100' ' ' THR . 0.8 OUTLIER 41.37 -155.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.92 0.39 . . . . 0.0 110.89 179.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.576 ' CG2' ' H ' ' A' ' 101' ' ' SER . 0.4 OUTLIER -156.94 -98.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.499 -179.903 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.576 ' H ' ' CG2' ' A' ' 100' ' ' THR . 45.6 p -141.58 167.86 21.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.464 ' CG ' ' O ' ' A' ' 101' ' ' SER . 13.3 p30 47.18 -167.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.529 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.0 t -137.56 145.62 43.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.516 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.461 ' CD2' ' N ' ' A' ' 104' ' ' LEU . 3.4 mm? -106.0 131.11 53.68 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.292 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 91.5 p -158.11 163.23 37.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.63 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 93.24 50.73 2.35 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 92.7 m -62.01 -45.03 95.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.684 0.278 . . . . 0.0 110.852 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -88.23 103.1 15.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.468 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 111' ' ' GLY . 70.0 mm-40 -70.67 -41.79 71.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.791 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 65.4 t0 49.17 -86.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.611 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 109' ' ' GLU . . . -154.13 -59.52 0.01 OUTLIER Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.721 -0.951 . . . . 0.0 110.721 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.647 ' N ' ' CD2' ' A' ' 112' ' ' LEU . 0.8 OUTLIER -89.22 127.38 35.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.736 0.303 . . . . 0.0 110.343 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' A' ' 113' ' ' ASP . 22.7 p-10 -101.32 -42.9 6.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.7 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -96.39 147.94 33.71 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.406 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.35 -30.54 29.95 Favored 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 122.646 2.231 . . . . 0.0 112.239 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 68.3 mtp85 -64.3 -43.62 94.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.881 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.464 ' N ' ' CD1' ' A' ' 117' ' ' LEU . 10.0 mp -63.58 -38.89 92.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.714 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.605 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 99.1 mt-10 -56.17 -31.34 63.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.071 0.462 . . . . 0.0 110.444 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.59 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 99.6 mttt -64.66 -48.12 75.95 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.533 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 50.7 mt -71.42 -45.83 61.71 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.983 0.42 . . . . 0.0 111.889 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.448 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 9.4 t-105 -58.67 -48.69 80.23 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.605 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.2 m-70 -69.87 -32.59 71.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.378 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 13.1 tptt -59.31 -48.55 81.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.733 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.98 -47.61 65.16 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.696 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -57.23 -49.51 75.79 Favored 'General case' 0 C--O 1.23 0.04 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.121 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 5.2 m -74.91 -46.43 36.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.74 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 41.7 p -45.85 -29.26 1.3 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.122 -178.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -155.72 -95.63 0.11 Allowed Glycine 0 N--CA 1.463 0.489 0 C-N-CA 119.928 -1.129 . . . . 0.0 111.173 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.568 ' C ' ' H ' ' A' ' 131' ' ' SER . 26.9 mttm -163.86 27.87 0.08 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.47 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.6 m-30 -63.5 44.58 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.651 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.568 ' H ' ' C ' ' A' ' 129' ' ' LYS . 9.5 p -100.95 112.4 24.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.436 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 124.98 -97.12 0.53 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.076 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -78.17 -42.88 30.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.854 0.359 . . . . 0.0 110.841 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.47 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 53.0 mp0 -60.63 -53.56 55.98 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.948 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.8 mt -61.84 -41.18 97.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.175 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -60.0 -44.53 94.49 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.085 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -59.61 -43.84 93.62 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.449 HD23 ' N ' ' A' ' 138' ' ' LEU . 3.0 mm? -59.31 -42.53 91.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.293 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.532 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -64.94 -37.82 88.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.42 -0.809 . . . . 0.0 113.027 176.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 94.5 mtt180 -52.37 -43.72 64.85 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.64 -40.1 76.72 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.776 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.532 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.2 m-85 -58.36 -55.22 37.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.33 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 59.9 mt -59.66 -38.48 81.57 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.22 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.428 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 54.0 m170 -54.1 -47.66 71.53 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.848 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.43 ' HD1' HG23 ' A' ' 197' ' ' ILE . 8.0 m-70 -61.71 -39.19 90.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -60.34 -41.98 94.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.26 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -65.01 -55.17 20.52 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.823 0.344 . . . . 0.0 111.297 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.43 -45.22 94.08 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.987 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.46 ' CG1' ' ND2' ' A' ' 153' ' ' ASN . 51.5 t -64.1 -35.5 73.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.949 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.608 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.2 m170 -66.1 -41.75 90.2 Favored 'General case' 0 C--O 1.209 -1.042 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.014 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.9 -43.65 98.24 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.091 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.49 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 17.1 m-85 -70.5 -46.45 63.67 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.544 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . 0.46 ' ND2' ' CG1' ' A' ' 149' ' ' VAL . 89.5 m-20 -67.55 -42.59 82.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.59 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.608 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 76.2 t -61.54 -47.05 95.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.034 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.5 mt -64.12 -44.58 91.8 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.62 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.419 ' O ' ' HB3' ' A' ' 160' ' ' SER . 19.5 mt -63.75 -43.54 96.15 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.659 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . 0.464 ' HA ' ' OG ' ' A' ' 160' ' ' SER . 69.3 mm-40 -65.65 -31.88 73.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.154 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 66.6 m -65.57 -49.15 69.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.722 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.423 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 2.1 pp -79.13 -21.13 46.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.514 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.464 ' OG ' ' HA ' ' A' ' 157' ' ' GLU . 93.2 p -66.89 -20.7 65.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.436 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -59.2 -42.01 89.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.911 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.81 31.57 0.61 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.633 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -137.15 -40.14 0.59 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.991 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 67.3 tt0 -92.38 24.51 3.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.971 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.468 HG13 ' N ' ' A' ' 166' ' ' HIS . 8.8 tp -55.5 155.23 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.466 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.468 ' N ' HG13 ' A' ' 165' ' ' ILE . 40.2 m80 -112.94 62.87 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.026 0.441 . . . . 0.0 110.015 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.17 26.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.514 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -167.27 118.55 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.453 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 4.7 t -118.96 25.0 4.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.684 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 9.9 tp -145.01 136.65 20.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.756 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.08 156.4 69.48 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.528 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.22 -5.59 16.38 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.823 2.349 . . . . 0.0 112.082 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 30.6 t -45.66 132.9 8.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.612 -179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -170.57 52.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.431 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.481 ' O ' ' OG ' ' A' ' 176' ' ' SER . 64.3 mt -105.8 38.45 2.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.619 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.481 ' OG ' ' O ' ' A' ' 175' ' ' LEU . 90.5 p 53.86 56.71 6.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.345 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 23.2 t0 54.79 30.02 12.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.525 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 24.1 mm 48.34 91.52 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.716 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -66.09 -40.64 90.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.532 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 148.06 0.02 0.58 Allowed Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 9.8 t -64.61 -43.08 94.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.015 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.642 ' C ' ' H ' ' A' ' 184' ' ' HIS . 24.2 t -132.65 168.91 23.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.695 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.438 ' N ' ' CG1' ' A' ' 182' ' ' VAL . 3.1 mt 64.74 -16.37 0.09 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.879 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.642 ' H ' ' C ' ' A' ' 182' ' ' VAL . 0.4 OUTLIER -58.25 -41.1 83.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.531 -179.814 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.587 ' H ' ' CD2' ' A' ' 184' ' ' HIS . 11.4 t -61.56 -44.32 97.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.153 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.412 ' O ' ' CD1' ' A' ' 190' ' ' LEU . 79.3 mtp85 -61.75 -44.79 96.2 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.806 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -67.57 -38.36 83.98 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.386 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.1 m -63.19 -44.44 95.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.338 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.1 -44.9 90.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.354 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.464 HD11 ' N ' ' A' ' 190' ' ' LEU . 8.1 mp -62.83 -42.64 99.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.691 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.505 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.1 mttm -67.97 -34.2 76.09 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.935 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.6 tt0 -67.69 -47.6 68.97 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.218 0.532 . . . . 0.0 111.362 -178.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.49 ' CE ' ' CD1' ' A' ' 152' ' ' TYR . 12.4 ptmt -73.28 -40.64 64.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.44 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.579 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.9 -40.29 75.72 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.818 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.657 ' NH1' HE22 ' A' ' 199' ' ' GLN . 3.4 ppt_? -65.6 -37.56 86.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.452 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 89.6 p -62.67 -43.88 97.68 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . 0.43 HG23 ' HD1' ' A' ' 145' ' ' HIS . 96.8 mt -65.86 -43.34 93.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.782 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -60.87 -40.93 94.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.361 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.657 HE22 ' NH1' ' A' ' 195' ' ' ARG . 31.8 mt-30 -63.08 -38.56 91.66 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.576 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.76 -43.89 98.6 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 18.9 mt -64.39 -39.04 93.09 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.01 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -59.76 -39.96 86.57 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.498 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 6.4 tmm_? -63.1 -42.68 99.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.393 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.86 -40.62 96.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.396 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -61.44 -41.68 97.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.749 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.707 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.1 mtp180 -62.3 -40.84 97.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.365 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.609 ' O ' ' N ' ' A' ' 211' ' ' GLY . 43.0 t -63.52 -46.09 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.083 0.468 . . . . 0.0 110.313 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -69.84 -26.65 64.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.508 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 41.1 m170 -101.81 -14.49 17.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.147 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.707 ' N ' ' O ' ' A' ' 206' ' ' ARG . 64.1 tp60 -132.27 -37.84 1.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.765 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.609 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -52.86 -14.39 2.64 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.482 ' O ' ' N ' ' A' ' 214' ' ' THR . 2.7 m-85 -59.53 145.7 43.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.954 0.407 . . . . 0.0 110.688 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 27.4 t -50.39 89.58 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.348 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.482 ' N ' ' O ' ' A' ' 212' ' ' TYR . 24.4 p -124.13 10.1 8.72 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.888 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 65.09 103.73 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.067 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . 179.19 86.18 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.302 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -143.7 35.93 1.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.018 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.538 ' O ' ' HB3' ' A' ' 219' ' ' GLU . 4.3 m-85 -65.04 152.24 43.94 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 110.469 -0.196 . . . . 0.0 110.469 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.538 ' HB3' ' O ' ' A' ' 218' ' ' PHE . 83.3 tt0 74.61 -19.79 0.36 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 178.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 221' ' ' PRO . 32.4 mm-40 -89.65 150.95 45.16 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.589 ' O ' ' HB3' ' A' ' 222' ' ' ARG . 51.1 Cg_exo -51.54 -155.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.771 2.314 . . . . 0.0 111.874 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.589 ' HB3' ' O ' ' A' ' 221' ' ' PRO . 41.5 ttm180 87.62 -102.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.71 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.419 ' CG1' ' N ' ' A' ' 224' ' ' ILE . 14.4 p -59.15 -44.95 92.89 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 110.636 -179.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.419 ' N ' ' CG1' ' A' ' 223' ' ' VAL . 4.1 mm -61.6 -41.14 89.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.075 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -60.98 -39.65 90.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.91 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 7.7 mt -59.71 -41.81 91.64 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.28 0.562 . . . . 0.0 109.769 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 54.8 m0 -61.42 -43.04 99.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.916 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.56 -25.52 65.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 232' ' ' SER . 2.8 mt -65.39 -43.33 91.02 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.93 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.438 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -34.8 -44.22 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.794 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -62.6 -47.91 81.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.652 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.547 ' O ' ' O ' ' A' ' 233' ' ' ALA . 35.7 t -67.6 -40.02 84.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.565 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . 0.547 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -47.93 -111.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.732 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -157.43 111.72 2.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 78.2 mt -146.36 161.64 39.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 236' ' ' THR . . . . . 0.549 ' OG1' ' HG2' ' A' ' 239' ' ' GLU . 0.0 OUTLIER -83.1 165.43 19.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.686 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -60.65 -47.38 86.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.991 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.1 -47.43 85.31 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 110.552 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . 0.549 ' HG2' ' OG1' ' A' ' 236' ' ' THR . 5.7 mm-40 -66.3 -35.77 81.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.002 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . 0.466 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.11 -43.31 98.79 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.206 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -63.01 -48.99 76.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.398 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.69 -44.18 97.43 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.344 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.523 ' HB2' ' HE ' ' A' ' 319' ' ' ARG . 0.6 OUTLIER -62.41 -43.87 97.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.122 179.062 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -59.37 -46.69 87.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.047 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -66.19 -44.07 85.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.706 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -59.66 -49.59 77.14 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.597 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.6 mm? -62.65 -38.32 89.84 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.525 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.41 -41.14 84.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.829 0.347 . . . . 0.0 110.071 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -66.51 -61.01 2.21 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.555 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . 0.434 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 25.3 t80 -59.58 -45.76 90.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.511 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.6 tp10 -54.88 -38.51 67.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.163 0.506 . . . . 0.0 109.701 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.31 82.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.244 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -60.72 -47.94 84.03 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.857 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.469 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 2.6 tp -63.49 -37.39 79.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.126 179.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -59.66 -44.02 93.72 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 121.07 0.462 . . . . 0.0 109.888 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -63.27 -42.41 99.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.134 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . 0.411 ' NE2' HG23 ' A' ' 297' ' ' THR . 15.5 t-80 -56.93 -42.43 80.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.159 0.504 . . . . 0.0 110.127 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -63.24 -40.0 96.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.084 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . 0.456 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -58.35 -46.58 86.0 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.147 0.499 . . . . 0.0 110.338 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -62.98 -35.68 80.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.201 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.465 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 32.8 mm-40 -60.48 -45.02 95.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.117 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -62.05 -43.76 98.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.209 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . 0.456 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.8 mp0 -66.92 -37.86 85.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.203 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . 0.441 ' CD2' ' OE1' ' A' ' 294' ' ' GLU . 53.9 tp -62.39 -43.54 98.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.294 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -66.21 -45.39 80.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.429 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 51.8 mt -62.94 -43.22 98.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.243 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.68 -37.82 82.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.253 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.77 -45.49 86.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.446 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -62.81 -46.44 87.96 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.618 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 60.5 tptt -60.48 -42.08 95.52 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.658 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . 0.449 ' CD2' ' HE ' ' A' ' 287' ' ' ARG . 35.4 tp -61.78 -43.15 99.43 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.27 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -58.13 -42.81 86.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.176 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -73.56 -33.71 64.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.506 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . 0.406 ' O ' HG13 ' A' ' 277' ' ' VAL . . . -64.04 -40.78 97.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.656 -179.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -54.26 -18.9 4.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.892 0.377 . . . . 0.0 110.594 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 4.1 t -62.32 -32.86 73.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.636 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.487 HG13 ' H ' ' A' ' 278' ' ' GLY . 10.4 p -58.67 -45.16 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.421 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.487 ' H ' HG13 ' A' ' 277' ' ' VAL . . . 79.0 -10.26 34.42 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . 0.487 ' H ' HG12 ' A' ' 277' ' ' VAL . 54.1 m-20 -61.78 -38.6 88.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.661 0.267 . . . . 0.0 110.549 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . 0.661 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 98.11 -146.49 18.22 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . 0.458 ' OE1' ' C ' ' A' ' 280' ' ' GLY . 51.5 mp0 57.97 -65.03 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 110.778 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . 0.661 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -63.33 -37.97 89.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.665 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.81 -46.74 95.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.518 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 284' ' ' SER . . . . . 0.451 ' O ' ' OE1' ' A' ' 288' ' ' GLU . 12.0 t -63.1 -47.44 82.84 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.052 0.454 . . . . 0.0 110.933 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 73.3 ttp85 -64.11 -42.99 96.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.82 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 42.1 t -60.28 -43.79 95.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.453 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . 0.636 ' NH2' ' CG ' ' A' ' 290' ' ' HIS . 5.5 mmp_? -64.12 -37.74 88.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.06 0.457 . . . . 0.0 110.677 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . 0.451 ' OE1' ' O ' ' A' ' 284' ' ' SER . 0.4 OUTLIER -60.22 -56.38 22.21 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.324 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . 0.407 ' HZ1' HD23 ' A' ' 292' ' ' LEU . 28.3 mmtt -65.57 -34.94 79.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.979 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . 0.636 ' CG ' ' NH2' ' A' ' 287' ' ' ARG . 42.8 t-80 -51.84 -48.68 63.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.66 -37.01 79.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.541 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . 0.407 HD23 ' HZ1' ' A' ' 289' ' ' LYS . 14.6 tp -62.2 -49.93 73.79 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.555 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . 0.463 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.4 mp -62.91 -41.33 99.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.134 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.441 ' OE1' ' CD2' ' A' ' 264' ' ' LEU . 29.5 tp10 -62.99 -41.25 99.52 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -59.51 -48.22 87.08 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.15 -40.23 89.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 0.0 110.231 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.465 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 0.2 OUTLIER -56.84 -47.48 80.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.105 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -63.12 -42.41 99.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.452 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.73 -47.55 76.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.479 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.24 -43.44 96.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.512 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.82 -42.02 84.8 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . 0.602 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 53.5 t80 -62.66 -46.62 87.34 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.422 0.629 . . . . 0.0 110.587 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 303' ' ' THR . . . . . 0.417 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 15.7 m -61.69 -45.93 91.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.454 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.51 -30.74 50.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.203 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -62.6 -55.04 30.87 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 121.141 0.496 . . . . 0.0 110.516 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . 0.602 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 77.5 mttt -62.17 -42.67 99.49 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.81 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.417 ' ND1' ' O ' ' A' ' 303' ' ' THR . 60.2 m80 -63.9 -32.01 73.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.988 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.75 -48.44 79.19 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -66.84 -41.1 87.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.697 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -62.08 -49.12 77.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.793 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 26.6 mt -63.51 -40.58 97.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.029 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 312' ' ' SER . . . . . 0.47 ' O ' ' OG ' ' A' ' 316' ' ' SER . 6.7 t -60.02 -44.31 94.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.29 -44.86 84.31 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.685 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -65.84 -43.61 87.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.877 0.37 . . . . 0.0 111.114 -179.599 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.3 mm -69.76 -24.02 26.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.47 ' OG ' ' O ' ' A' ' 312' ' ' SER . 67.7 m -59.14 -43.13 92.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.204 0.526 . . . . 0.0 110.057 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.86 -2.66 34.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.251 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 61.62 -141.84 0.46 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.524 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.523 ' HE ' ' HB2' ' A' ' 243' ' ' PHE . 1.5 mpt_? -108.7 -82.08 0.56 Allowed 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.407 -178.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 74.2 -11.27 1.01 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.032 0.444 . . . . 0.0 110.595 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.452 ' H ' ' C ' ' A' ' 319' ' ' ARG . 0.2 OUTLIER -176.85 35.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.516 ' CA ' ' OE1' ' A' ' 239' ' ' GLU . 81.4 tt0 56.74 154.19 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.543 -178.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 117.866 -1.064 . . . . 0.0 110.599 -179.728 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 93.8 p -75.51 171.1 14.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.522 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.455 HH11 ' HD3' ' A' ' 3' ' ' ARG . 42.7 ttp-105 65.23 125.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.575 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -132.66 156.65 46.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.147 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -111.14 138.99 46.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.622 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.408 ' OD1' ' O ' ' A' ' 6' ' ' ASN . 17.5 p30 -160.78 128.71 4.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.541 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 25.5 mp0 -141.94 60.68 11.37 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.899 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' O ' ' CB ' ' A' ' 9' ' ' LYS . 72.3 Cg_endo -75.11 149.57 36.46 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 123.028 2.485 . . . . 0.0 112.391 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.439 ' CB ' ' O ' ' A' ' 8' ' ' PRO . 23.0 tttp 164.88 130.42 0.03 OUTLIER Pre-proline 0 CA--C 1.534 0.335 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.353 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.33 155.29 60.57 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 122.373 2.049 . . . . 0.0 111.802 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.8 p -89.14 130.53 43.92 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.858 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -76.2 -18.64 16.09 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.864 2.376 . . . . 0.0 112.028 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -85.01 159.4 20.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.592 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -129.24 148.68 51.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.278 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -119.2 124.58 47.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.62 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.9 t -156.9 152.69 27.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.518 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -94.51 -172.61 38.15 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.834 -0.907 . . . . 0.0 110.834 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -108.72 124.7 50.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.717 0.294 . . . . 0.0 110.331 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -79.64 -12.65 59.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.733 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -132.13 167.22 20.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.777 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -61.19 -40.34 93.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 88.8 mmm -121.25 149.08 43.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.418 0.627 . . . . 0.0 111.074 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 23' ' ' GLU . 4.2 pm0 -61.58 -40.33 94.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.435 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -52.31 -48.79 65.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.179 0.514 . . . . 0.0 110.668 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.81 -39.47 91.87 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.359 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.9 t-20 -62.91 -38.82 92.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.189 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -61.74 -43.52 98.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.354 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.29 -42.68 99.06 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -61.16 -47.14 87.56 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.234 0.54 . . . . 0.0 110.44 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -57.51 -41.99 81.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -61.23 -43.1 99.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.238 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.87 88.11 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.071 0.462 . . . . 0.0 110.082 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.646 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 24.5 mt-30 -59.41 -39.31 83.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.173 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.603 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 61.6 ttt85 -60.96 -39.88 91.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.373 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.67 -34.53 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.296 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.646 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 24.9 m80 66.41 118.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.5 mt -137.13 154.61 75.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.115 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -41.74 154.62 0.09 OUTLIER 'Trans proline' 0 C--N 1.312 -1.354 0 C-N-CA 122.504 2.136 . . . . 0.0 112.41 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -56.5 -47.49 23.69 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.511 2.141 . . . . 0.0 112.375 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.8 -45.71 94.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.447 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpt180 -62.52 -41.89 99.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.58 -43.61 98.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.715 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.26 89.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.595 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -68.67 -42.38 77.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.528 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 50.9 tp -63.04 -48.67 77.74 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.23 0.538 . . . . 0.0 110.661 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -59.96 -42.77 94.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.25 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.6 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.33 -46.56 88.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.607 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -55.8 -47.78 76.53 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.485 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.0 -40.74 85.82 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.139 0.495 . . . . 0.0 109.988 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.49 -39.14 82.77 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.947 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 47' ' ' ALA . 35.9 mm -62.83 -42.71 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.59 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -55.79 -46.79 77.89 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.444 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -60.06 -50.48 73.56 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.355 0.597 . . . . 0.0 110.419 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.313 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -61.21 -40.57 94.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.385 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.18 -51.02 67.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.05 -39.65 93.09 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.242 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.5 92.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.63 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.429 ' CZ3' ' HD3' ' A' ' 63' ' ' LYS . 89.3 t90 -61.87 -40.26 94.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.267 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.743 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 87.8 tttt -57.61 -49.33 76.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.463 0.649 . . . . 0.0 109.556 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -66.46 -41.27 89.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.182 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.46 -44.16 97.59 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.618 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.743 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 18.4 pttm -61.93 -39.19 91.19 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 63' ' ' LYS . 56.5 tp -58.63 -44.09 89.93 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.509 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -64.87 -37.64 88.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.191 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 92.13 56.95 1.53 Allowed Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 95.5 mt -116.83 -10.44 11.04 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.798 0.332 . . . . 0.0 110.76 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.567 ' OD2' ' N ' ' A' ' 71' ' ' GLY . 5.1 t70 -77.57 121.9 24.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.243 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.441 ' OE1' ' OE2' ' A' ' 72' ' ' GLU . 94.1 mt-10 -49.87 -85.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.793 -179.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -131.32 42.78 3.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.795 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.567 ' N ' ' OD2' ' A' ' 68' ' ' ASP . . . 80.3 18.48 71.44 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.441 ' OE2' ' OE1' ' A' ' 69' ' ' GLU . 96.0 mt-10 -60.61 -35.03 75.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.796 0.331 . . . . 0.0 110.361 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -62.07 -48.32 80.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.23 0.538 . . . . 0.0 110.003 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.37 -39.32 90.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.252 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.41 94.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.208 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -63.66 -39.74 95.1 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.466 -0.493 . . . . 0.0 109.754 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.7 mt -62.62 -45.23 93.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.431 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.24 -44.58 95.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.056 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -58.1 -42.63 86.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.885 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.429 ' O ' HG13 ' A' ' 84' ' ' ILE . 11.5 m120 -62.72 -39.62 94.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.308 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.403 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -57.78 -49.63 75.96 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.96 -179.359 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.446 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 53.9 t-20 -64.68 -37.37 87.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.336 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 72.7 t -63.16 -45.8 97.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.466 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.444 HG21 HD13 ' A' ' 84' ' ' ILE . 97.0 mt -59.17 -50.34 80.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.061 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.438 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.6 mm? -65.44 -39.77 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.769 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.84 -45.23 95.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.65 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -62.83 -45.87 90.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.849 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -64.44 -28.04 69.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.297 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.18 23.29 61.45 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.7 mt -93.8 2.32 56.24 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.8 0.333 . . . . 0.0 110.398 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -84.87 -1.95 57.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.572 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -59.58 163.38 13.44 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.289 -0.725 . . . . 0.0 111.289 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -133.21 170.84 14.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.752 0.31 . . . . 0.0 110.755 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.531 ' O ' ' O ' ' A' ' 95' ' ' ASP . 99.2 mttt -56.13 -76.53 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.636 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.634 ' O ' ' N ' ' A' ' 97' ' ' ARG . 37.6 t70 55.91 137.42 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.69 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 58.15 -68.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.456 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.634 ' N ' ' O ' ' A' ' 95' ' ' ASP . 70.8 ttt180 58.62 154.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.446 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.1 142.36 56.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.184 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 34.8 m -129.21 157.73 41.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.23 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.427 ' O ' ' ND2' ' A' ' 102' ' ' ASN . 27.1 m -63.53 134.32 55.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.033 -179.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 20.8 p -60.11 142.85 53.52 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.324 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.427 ' ND2' ' O ' ' A' ' 100' ' ' THR . 70.7 m-80 -159.44 35.76 0.2 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.672 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 79.7 p -69.57 -12.54 61.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.45 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.59 -39.81 92.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.681 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 39.4 t -58.07 -43.36 86.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.391 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 79.9 -94.0 1.42 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 92.8 m -118.79 129.09 55.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.921 0.391 . . . . 0.0 110.482 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -135.97 74.77 1.52 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.521 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -157.54 113.42 2.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.506 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.464 ' O ' ' OD1' ' A' ' 110' ' ' ASP . 51.3 p-10 -151.86 88.5 1.4 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.511 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.825 ' HA3' ' NE2' ' A' ' 122' ' ' HIS . . . -64.24 -41.81 98.13 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 37.6 tp -160.31 -84.29 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.648 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -163.56 -65.27 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.661 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.94 128.02 77.89 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.434 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.431 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 50.3 Cg_exo -51.19 -39.54 61.54 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 122.422 2.081 . . . . 0.0 112.502 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 82.5 mtm180 -61.03 -45.44 94.76 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.984 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.1 mt -68.33 -40.14 81.71 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.234 0.54 . . . . 0.0 110.664 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.56 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 96.8 mt-10 -58.81 -33.18 70.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.333 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 56.6 mttp -60.8 -47.97 83.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.712 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.19 -45.82 86.65 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.206 0.527 . . . . 0.0 111.928 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.416 ' CE2' HD11 ' A' ' 135' ' ' LEU . 14.3 t-105 -60.86 -51.5 69.05 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.975 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.825 ' NE2' ' HA3' ' A' ' 111' ' ' GLY . 9.7 m-70 -68.88 -29.32 67.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.234 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.634 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.1 tptt -57.6 -49.97 74.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.452 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.68 -47.56 53.33 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 119.3 -0.96 . . . . 0.0 111.022 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -53.21 -48.47 68.1 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.875 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 10.5 m -78.91 -43.28 25.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.897 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.589 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 18.0 m -44.73 -28.49 0.63 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -163.87 -96.03 0.11 Allowed Glycine 0 C--N 1.321 -0.259 0 C-N-CA 119.684 -1.246 . . . . 0.0 111.576 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.638 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -152.02 20.5 0.68 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.453 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 2.6 m-85 -59.53 41.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.613 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.638 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.5 p -103.0 114.46 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.976 0.417 . . . . 0.0 111.247 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.442 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 120.92 -96.88 0.61 Allowed Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.788 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.457 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 79.7 mm-40 -72.97 -43.77 61.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.909 0.385 . . . . 0.0 111.342 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 4.1 mp0 -65.52 -45.8 82.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.126 0.489 . . . . 0.0 110.165 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.442 ' HB2' ' H ' ' A' ' 132' ' ' GLY . 1.7 mt -60.64 -41.9 95.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.898 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.502 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -63.01 -40.23 97.15 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.92 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -59.56 -44.36 93.3 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 121.273 0.558 . . . . 0.0 110.207 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.431 ' N ' HD22 ' A' ' 138' ' ' LEU . 3.1 mm? -60.84 -42.52 97.94 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -30.67 70.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 176.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' A' ' 136' ' ' ASP . 59.6 mmt-85 -59.02 -44.16 91.69 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.432 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -71.02 -39.44 72.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.859 179.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.27 -58.28 9.2 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.565 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 93.9 mt -61.0 -39.29 89.12 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.218 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -55.25 -43.02 74.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.441 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -64.84 -38.23 90.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.407 ' O ' HG12 ' A' ' 149' ' ' VAL . 51.5 mmtt -59.64 -45.03 93.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.403 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -70.48 -51.74 26.91 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.739 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.442 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 14.5 mptt -62.54 -44.51 96.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.157 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 146' ' ' LYS . 2.6 p -63.77 -35.95 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.501 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.602 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 1.9 m170 -66.01 -43.23 88.32 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.665 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.99 -44.7 96.18 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.364 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.442 ' CD2' ' O ' ' A' ' 148' ' ' LYS . 31.4 m-85 -69.58 -46.76 65.61 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.904 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -65.59 -41.07 93.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.103 0.478 . . . . 0.0 110.527 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.602 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 63.8 t -63.08 -43.92 99.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.674 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 44.7 mt -62.66 -44.24 96.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.561 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 15.7 mt -63.74 -42.68 97.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.699 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -68.81 -25.52 64.72 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.933 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 58.5 m -70.63 -47.43 60.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.852 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.9 pp -78.72 -24.44 44.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.621 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 97.6 p -60.81 -42.93 98.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.69 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -64.42 -43.29 94.83 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 -179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 3.1 m -85.2 38.91 0.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.501 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -126.62 -27.14 3.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.0 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -100.75 23.07 11.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.339 0.59 . . . . 0.0 110.105 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.6 tt -57.15 136.99 19.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.741 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.687 ' C ' ' H ' ' A' ' 168' ' ' ASN . 35.6 m170 -135.79 26.01 3.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.05 0.453 . . . . 0.0 109.98 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 167' ' ' GLU . 78.5 tt0 -65.02 25.54 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.393 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.687 ' H ' ' C ' ' A' ' 166' ' ' HIS . 29.1 p30 -174.39 -165.93 0.24 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.453 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 6.3 p -81.23 135.34 25.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.437 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 20.1 tt -85.74 133.71 28.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.53 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' SER . . . . . 0.619 ' O ' ' N ' ' A' ' 173' ' ' SER . 0.0 OUTLIER -139.44 161.55 56.42 Favored Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.211 179.868 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -46.98 75.02 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 122.812 2.342 . . . . 0.0 112.263 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.619 ' N ' ' O ' ' A' ' 171' ' ' SER . 87.6 p -163.6 159.32 21.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.685 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -123.29 -9.96 8.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.343 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.562 ' O ' ' N ' ' A' ' 177' ' ' ASP . 4.0 tp -157.08 169.23 25.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.4 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.519 ' H ' ' HG ' ' A' ' 175' ' ' LEU . 38.1 t -60.15 72.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.29 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.562 ' N ' ' O ' ' A' ' 175' ' ' LEU . 52.8 t0 48.99 106.14 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.832 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 3.3 pt -130.96 133.06 63.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.765 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -98.29 19.45 14.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.351 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 91.44 32.24 8.9 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 37.4 m -62.16 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.835 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.604 ' O ' ' N ' ' A' ' 184' ' ' HIS . 4.3 t -142.09 -130.38 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.543 -179.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.539 ' H ' ' CG1' ' A' ' 182' ' ' VAL . 4.9 tt 61.54 -49.65 0.13 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.838 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.604 ' N ' ' O ' ' A' ' 182' ' ' VAL . 15.4 p80 -58.71 -43.69 90.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.505 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.582 ' OG ' ' CE1' ' A' ' 184' ' ' HIS . 59.2 m -64.42 -41.78 96.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.544 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 75.3 mtm180 -64.44 -46.77 81.7 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.581 -0.448 . . . . 0.0 112.054 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . 0.647 ' C ' ' ND1' ' A' ' 187' ' ' HIS . 0.1 OUTLIER -71.97 -34.77 69.23 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.785 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' THR . . . . . 0.627 ' N ' ' ND1' ' A' ' 187' ' ' HIS . 59.6 m -62.88 -46.13 89.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.82 179.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 193' ' ' LYS . 75.7 mm-40 -62.49 -34.33 76.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.573 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.539 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 21.1 mt -61.16 -41.62 97.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.932 0.396 . . . . 0.0 110.208 178.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -67.68 -35.92 79.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.815 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 79.8 mm-40 -67.06 -45.65 76.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.981 0.42 . . . . 0.0 111.492 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.539 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 4.5 ptmt -69.25 -36.54 77.25 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.936 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.585 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -62.53 -44.11 97.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.989 -179.521 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.525 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 16.0 ptm180 -65.78 -35.87 81.93 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.417 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.423 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 72.4 m -59.5 -40.56 87.43 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.76 -42.98 97.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.399 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -58.84 -41.99 88.24 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.61 -38.54 88.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.33 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.55 -41.68 97.36 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.213 -1.155 . . . . 0.0 110.213 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 20.4 mt -61.94 -40.14 94.5 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.672 178.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -62.04 -36.53 81.87 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.445 ' HD3' ' O ' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -62.45 -42.49 99.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.248 178.832 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.4 mt -60.19 -39.36 86.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.451 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -60.44 -41.8 94.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.604 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.642 ' O ' ' N ' ' A' ' 210' ' ' GLN . 25.9 mmt85 -62.43 -38.62 90.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.117 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.591 ' O ' ' N ' ' A' ' 211' ' ' GLY . 30.4 t -63.64 -45.09 98.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.302 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -66.13 -28.17 68.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.471 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -94.64 -39.45 10.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.026 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.642 ' N ' ' O ' ' A' ' 206' ' ' ARG . 56.2 tt0 -96.16 -40.46 9.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.399 . . . . 0.0 110.715 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -84.16 30.58 3.61 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.544 ' CE1' ' OG ' ' A' ' 127' ' ' SER . 87.4 t80 -59.36 -48.29 82.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.66 0.267 . . . . 0.0 110.673 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.704 ' OG ' ' N ' ' A' ' 214' ' ' THR . 18.8 p -172.51 -85.39 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.676 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.704 ' N ' ' OG ' ' A' ' 213' ' ' SER . 0.5 OUTLIER 175.48 173.77 0.27 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.489 -179.681 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . 0.569 ' OE1' ' N ' ' A' ' 215' ' ' GLU . 56.6 mp0 -112.9 179.99 3.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.446 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . 63.07 123.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.234 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -137.6 35.48 2.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.0 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.624 ' HD1' ' N ' ' A' ' 218' ' ' PHE . 0.0 OUTLIER -59.32 -14.74 12.62 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.369 -179.862 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.452 ' HG3' ' CE1' ' A' ' 218' ' ' PHE . 96.9 mt-10 -65.63 -41.01 93.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.655 ' C ' ' H ' ' A' ' 222' ' ' ARG . 7.3 mt-10 41.12 103.69 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.264 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.486 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 32.1 Cg_exo -57.97 15.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 123.023 2.482 . . . . 0.0 112.243 177.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.655 ' H ' ' C ' ' A' ' 220' ' ' GLU . 84.8 mtt85 -112.66 -59.81 1.96 Allowed 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.853 0.359 . . . . 0.0 110.692 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.635 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 6.2 p -65.37 -64.61 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-O 121.404 0.621 . . . . 0.0 111.326 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.635 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 0.4 OUTLIER -62.3 -32.39 54.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.721 -179.151 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 21.8 t70 -63.0 -40.74 98.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.303 0.573 . . . . 0.0 109.836 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.8 mt -61.42 -40.78 95.66 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . 0.411 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 40.0 m0 -59.75 -38.28 81.33 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.059 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -63.22 -37.55 87.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.419 ' C ' ' H ' ' A' ' 231' ' ' GLN . 93.3 mt -63.96 -41.86 97.45 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.366 0.603 . . . . 0.0 110.199 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -50.03 -14.88 0.17 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.835 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.5 ' CG ' ' N ' ' A' ' 232' ' ' SER . 18.3 pt20 -64.82 -42.83 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.759 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.5 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 23.7 m -136.95 58.03 1.74 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -109.28 45.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.403 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 65.84 53.38 1.15 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.998 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . 0.444 ' N ' ' CD2' ' A' ' 235' ' ' LEU . 4.2 mm? -108.56 177.87 4.66 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.066 0.46 . . . . 0.0 110.447 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 236' ' ' THR . . . . . 0.477 ' OG1' ' CG ' ' A' ' 239' ' ' GLU . 60.6 p -84.57 -176.23 6.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.477 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -85.47 -50.78 7.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.202 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -62.01 -44.72 96.12 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.033 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . 0.477 ' CG ' ' OG1' ' A' ' 236' ' ' THR . 85.8 mt-10 -61.87 -34.28 75.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.77 -42.08 95.39 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.837 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -64.3 -49.09 73.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.512 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.42 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.126 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.3 -43.25 95.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.456 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -56.43 -51.28 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 110.381 -178.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -66.54 -39.95 88.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.744 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -58.89 -53.99 52.13 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.207 0.527 . . . . 0.0 110.447 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.08 -33.81 76.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.444 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.692 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.9 tttt -57.28 -44.96 84.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.224 0.535 . . . . 0.0 110.072 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -68.96 -44.04 73.77 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.604 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -61.24 -47.2 87.15 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 120.991 0.424 . . . . 0.0 111.088 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.692 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.0 OUTLIER -61.28 -36.27 79.58 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.72 87.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.69 -48.16 80.5 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.233 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.401 ' CD1' ' CE2' ' A' ' 218' ' ' PHE . 1.2 tt -65.02 -34.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.096 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -64.57 -44.73 89.8 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.34 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.82 -44.31 96.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.332 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -44.8 73.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -60.71 -40.76 93.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.29 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -59.78 -47.22 86.57 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.515 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -63.94 -34.52 78.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.397 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.561 HE21 ' CG2' ' A' ' 297' ' ' THR . 72.5 mm-40 -61.8 -46.87 87.66 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.189 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.99 -46.76 87.83 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.05 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -64.38 -34.96 79.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.987 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 60.5 tp -62.62 -42.9 99.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -64.81 -44.66 89.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.712 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.42 -43.26 98.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.192 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.4 -38.6 87.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.099 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -61.54 -46.79 88.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.87 -49.12 78.93 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -61.89 -38.75 89.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.516 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.04 -43.06 99.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.261 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -60.27 -43.27 96.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.403 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -65.9 -39.88 91.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.29 -38.32 89.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.941 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -63.9 -30.37 71.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.517 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 6.4 t -59.39 -40.16 85.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.536 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 91.5 t -60.75 -45.31 97.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.495 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 86.35 18.72 58.45 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.03 -38.24 90.36 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.292 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 81.47 -164.76 45.73 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 63.27 -70.58 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.8 0.333 . . . . 0.0 110.619 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 280' ' ' GLY . 11.2 ptp85 -67.97 -24.56 65.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.825 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.9 -47.59 92.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.421 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 38.6 t -66.55 -44.86 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.18 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.03 -49.49 77.19 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.876 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 71.7 m -60.83 -43.96 97.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -63.63 -39.06 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.724 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -58.36 -57.18 14.02 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.95 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -64.28 -36.49 84.27 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.077 179.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -49.23 -50.05 40.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.78 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.4 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.601 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 22.8 tp -59.98 -49.72 76.58 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.548 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.17 -42.07 99.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.014 0.435 . . . . 0.0 109.891 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.59 ' O ' ' OG1' ' A' ' 297' ' ' THR . 12.3 tm-20 -60.97 -40.12 92.2 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.04 -43.22 99.46 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.26 -43.95 98.04 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.227 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.59 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 25.3 p -57.36 -43.86 83.87 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.99 0.424 . . . . 0.0 110.121 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -62.79 -46.36 88.36 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.137 0.494 . . . . 0.0 110.681 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.52 -39.92 89.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.144 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.85 -43.86 98.0 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.152 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.72 -42.55 96.42 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -61.52 -44.89 96.25 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.137 0.494 . . . . 0.0 110.616 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.3 m -60.52 -43.93 96.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.352 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.8 t -59.81 -42.76 90.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.921 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.71 -50.51 72.97 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.031 0.443 . . . . 0.0 110.596 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -63.77 -41.18 98.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.682 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -66.23 -34.98 79.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.011 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 19.3 mt -62.14 -43.72 98.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.378 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -68.53 -43.87 75.83 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.737 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -64.15 -49.53 71.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.112 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 28.1 mt -63.89 -41.32 97.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.9 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 74.7 m -59.64 -41.81 91.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.545 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -68.4 -47.47 57.49 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -66.1 -42.35 89.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.785 0.326 . . . . 0.0 111.269 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -70.23 -23.75 25.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.94 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.4 t -59.66 -43.84 93.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 109.735 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -100.82 4.31 42.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.732 179.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.487 ' O ' HD22 ' A' ' 323' ' ' LEU . . . 54.57 -101.83 0.13 Allowed 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.288 -178.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.37 146.82 0.49 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.989 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -94.24 -26.16 16.76 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 37.5 p-10 -160.8 65.34 0.3 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.464 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 60.06 147.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.315 -179.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.487 HD22 ' O ' ' A' ' 318' ' ' ALA . 28.0 mt . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.552 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.492 ' CD1' ' O ' ' A' ' 2' ' ' SER . 55.4 t80 . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.492 ' O ' ' CD1' ' A' ' 1' ' ' TYR . 48.2 t -66.06 149.2 50.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.641 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -128.95 141.43 51.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.73 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -131.21 127.25 37.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.414 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -132.8 149.76 52.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.24 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -77.35 142.25 39.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.983 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.23 149.76 35.91 Favored Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.459 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.58 149.2 90.28 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.508 2.139 . . . . 0.0 112.174 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt -145.18 87.72 7.04 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.593 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.432 ' O ' ' CB ' ' A' ' 11' ' ' SER . 52.1 Cg_exo -52.07 -39.33 70.5 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.61 2.206 . . . . 0.0 112.053 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 10' ' ' PRO . 1.4 t 77.78 80.23 0.12 Allowed Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.23 146.77 93.52 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 123.126 2.55 . . . . 0.0 112.358 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -64.55 134.66 54.85 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.526 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.8 mtp180 -99.75 134.99 41.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.51 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -78.14 -82.23 0.09 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.63 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m 59.75 117.85 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.842 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.449 ' O ' ' O ' ' A' ' 18' ' ' GLU . . . -63.47 -40.41 98.77 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.834 -0.907 . . . . 0.0 110.834 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.449 ' O ' ' O ' ' A' ' 17' ' ' GLY . 79.9 mm-40 54.97 114.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.883 0.373 . . . . 0.0 110.82 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -65.58 -40.68 92.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.745 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -104.67 -175.08 2.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.489 ' C ' ' SD ' ' A' ' 22' ' ' MET . 85.5 mtp180 -92.38 -4.08 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.78 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.601 ' CG ' ' HZ3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -133.56 137.98 45.8 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.027 0.441 . . . . 0.0 111.109 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 16.6 pt-20 -65.12 -42.59 93.77 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.601 ' HZ3' ' CG ' ' A' ' 22' ' ' MET . 13.2 pttm -57.0 -45.42 83.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.0 0.429 . . . . 0.0 109.963 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.1 mp -61.62 -41.51 97.58 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.1 m-80 -62.09 -38.75 90.03 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.199 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -59.01 -48.78 80.36 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.885 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.432 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 4.1 mm? -61.97 -42.14 98.79 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.116 179.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.645 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 61.1 t-105 -61.12 -45.06 96.23 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.072 0.463 . . . . 0.0 110.383 179.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.439 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 81.3 tt0 -56.85 -46.04 82.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.372 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -61.71 -40.56 95.48 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.474 -0.491 . . . . 0.0 110.281 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.91 -43.9 86.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.645 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 88.2 mt-30 -62.81 -38.5 90.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.232 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.439 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -61.19 -41.66 97.21 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.376 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.17 -41.17 97.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.337 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.33 104.83 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.47 158.51 64.2 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.354 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -39.12 153.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.478 0 C-N-CA 122.593 2.195 . . . . 0.0 112.417 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.5 -41.77 68.25 Favored 'Trans proline' 0 N--CA 1.499 1.837 0 C-N-CA 122.812 2.341 . . . . 0.0 112.538 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 70.6 t -62.69 -46.42 96.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -64.76 -38.52 91.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.335 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.25 -46.08 88.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.18 -42.67 83.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.866 0.365 . . . . 0.0 110.816 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -67.63 -45.27 75.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.564 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.13 -48.89 76.57 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.523 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -60.3 -41.31 93.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.282 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.571 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.97 -50.41 74.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -57.65 -48.11 80.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.946 0.403 . . . . 0.0 110.996 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.71 -39.82 81.91 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.01 -40.46 89.34 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.882 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.571 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.6 mm -62.45 -43.84 98.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -58.42 -42.89 88.28 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.684 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.49 -49.56 77.05 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.155 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -63.0 -41.57 99.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.792 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 55' ' ' ASP . 48.5 t0 -63.34 -39.38 94.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.356 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.33 -46.38 90.51 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.848 0.356 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.6 tp -61.4 -43.52 98.73 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.722 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.98 -44.5 96.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.696 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.3 t90 -56.33 -42.45 77.7 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.2 tttt -60.52 -45.92 92.03 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.688 -0.405 . . . . 0.0 109.977 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -60.47 -42.64 96.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.265 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mp -62.03 -40.64 96.4 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.341 -0.544 . . . . 0.0 109.653 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.96 -40.72 85.6 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.67 -44.63 96.24 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -63.84 -37.33 86.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.307 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.98 52.92 1.57 Allowed Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 77.7 mt -112.21 -51.17 2.86 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.848 0.356 . . . . 0.0 110.986 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -66.27 138.08 57.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.333 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -159.36 -30.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.503 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 71' ' ' GLY . 47.5 p-10 -64.92 -34.26 77.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.594 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.539 ' N ' ' OD1' ' A' ' 70' ' ' ASP . . . 89.13 2.35 77.71 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -66.81 -34.39 77.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.453 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.449 ' HD2' ' N ' ' A' ' 73' ' ' LYS . 2.7 mptp? -61.44 -68.09 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.074 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -51.74 -39.14 57.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.367 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.53 95.11 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.412 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.462 ' NH1' HD22 ' A' ' 80' ' ' ASN . 73.7 ttt-85 -62.62 -43.07 99.73 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.01 -43.37 98.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.573 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.58 -44.69 98.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.148 0.499 . . . . 0.0 109.95 179.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -59.86 -41.74 92.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.236 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.462 HD22 ' NH1' ' A' ' 76' ' ' ARG . 92.1 m-20 -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.532 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -49.19 78.79 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.753 -179.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.422 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 50.8 t-20 -64.21 -40.44 96.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.678 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.0 -45.81 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.773 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.444 HG23 HD13 ' A' ' 84' ' ' ILE . 96.5 mt -60.65 -48.85 86.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.318 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.5 -38.56 90.08 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.76 77.27 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.319 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.73 -46.1 83.67 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.288 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -63.85 -27.7 69.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.946 0.403 . . . . 0.0 110.121 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.38 29.37 73.08 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.3 mt -102.3 17.33 23.73 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.878 0.37 . . . . 0.0 110.798 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -57.13 -48.59 78.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.777 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.467 ' O ' ' O ' ' A' ' 93' ' ' LYS . . . 107.02 55.52 0.64 Allowed Glycine 0 CA--C 1.528 0.889 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.467 ' O ' ' O ' ' A' ' 92' ' ' GLY . 98.7 mttt 45.3 -175.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.857 0.36 . . . . 0.0 110.69 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 25.0 pttm -109.08 63.46 0.6 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.956 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.457 ' OD2' ' O ' ' A' ' 97' ' ' ARG . 20.8 t70 -88.88 101.47 14.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.891 0.377 . . . . 0.0 110.658 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.93 -24.3 55.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.846 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.457 ' O ' ' OD2' ' A' ' 95' ' ' ASP . 19.2 ptp180 -80.35 140.73 35.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.678 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -145.71 160.57 41.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.263 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.6 t -115.74 130.55 70.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.1 p -62.93 -50.46 70.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.242 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.8 t -75.66 145.11 41.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.81 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -88.72 80.81 7.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.909 0.385 . . . . 0.0 110.286 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 8.3 t -65.84 -21.12 66.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.688 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.412 ' CD1' ' C ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER 50.37 89.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.664 179.818 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.2 t -143.62 134.4 25.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.551 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -99.29 -20.38 18.05 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.8 t -147.19 153.23 39.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.893 0.377 . . . . 0.0 110.706 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -162.12 153.99 18.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.347 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.54 ' OE1' ' N ' ' A' ' 109' ' ' GLU . 55.8 mp0 -127.44 141.21 51.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.78 0.324 . . . . 0.0 110.383 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.615 ' CG ' ' H ' ' A' ' 111' ' ' GLY . 10.1 p-10 -60.37 -82.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.651 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.615 ' H ' ' CG ' ' A' ' 110' ' ' ASP . . . 156.4 -98.26 0.17 Allowed Glycine 0 CA--C 1.522 0.501 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.2 tp -148.39 159.51 43.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.791 0.329 . . . . 0.0 110.743 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 46.0 p30 -115.35 12.51 16.38 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.018 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.545 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 5.3 m-20 -107.04 117.89 55.35 Favored Pre-proline 0 N--CA 1.466 0.369 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.698 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -66.9 -30.21 40.32 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.077 1.852 . . . . 0.0 112.537 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -68.17 -45.29 73.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.722 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 58.2 mt -82.7 -28.09 30.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.882 0.372 . . . . 0.0 110.644 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 77.9 mt-10 -60.48 -25.2 65.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.937 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.49 -55.76 29.53 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.52 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 32.1 mt -68.96 -42.33 76.76 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 112.112 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.472 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 7.5 t-105 -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.739 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.593 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.4 m-70 -68.0 -32.92 73.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.054 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.464 ' O ' ' CB ' ' A' ' 127' ' ' SER . 13.1 tptt -57.52 -49.56 75.93 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.96 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -69.15 -47.41 65.09 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.654 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.428 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 37.3 ttmt -54.6 -50.72 67.38 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.649 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 54.7 m -74.31 -41.9 60.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.932 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.3 t -48.62 -26.15 2.11 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 -178.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.67 -94.22 0.1 OUTLIER Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.041 -1.076 . . . . 0.0 111.515 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.517 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.4 pttm -162.83 30.97 0.1 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.504 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 6.5 m-85 -64.31 49.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.233 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.6 p -104.5 137.4 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.197 0.522 . . . . 0.0 111.767 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 95.45 -97.34 2.1 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-N 115.234 -0.893 . . . . 0.0 112.218 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -78.14 -43.91 27.49 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.8 0.333 . . . . 0.0 111.679 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.61 -52.52 64.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.054 0.454 . . . . 0.0 110.197 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 130' ' ' PHE . 1.6 mt -62.05 -41.44 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.938 179.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -61.3 -37.97 85.15 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 56.1 mmtt -62.03 -42.41 99.15 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.1 mp -59.73 -42.56 93.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -36.94 85.96 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.569 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 72.5 mtp85 -54.1 -42.13 69.06 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 118.588 -1.245 . . . . 0.0 108.149 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -69.23 -41.62 76.76 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.678 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -57.23 -57.57 12.02 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.583 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.56 -39.14 83.05 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.179 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.569 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 44.9 m170 -54.61 -43.16 71.96 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.416 -0.514 . . . . 0.0 109.846 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.62 -39.13 88.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.574 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -59.75 -46.3 89.57 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.192 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 10.2 pt-20 -69.89 -44.82 68.97 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.406 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 86.1 mttt -62.92 -46.7 86.58 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.233 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 55.1 t -64.49 -44.27 96.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.397 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.578 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.4 m170 -60.87 -38.54 85.98 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.465 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -61.49 -44.75 96.53 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.992 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.564 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 31.3 m-85 -66.74 -49.67 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.381 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -65.66 -41.03 93.01 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.953 0.406 . . . . 0.0 111.164 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.578 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 66.9 t -63.57 -44.54 98.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.727 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.2 mt -63.41 -44.89 93.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.511 179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 20.6 mt -63.9 -42.59 97.39 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.692 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . 0.496 ' C ' ' HG ' ' A' ' 160' ' ' SER . 76.3 mm-40 -67.32 -29.89 69.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.098 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 62.6 m -67.79 -48.24 66.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.568 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.7 pp -78.82 -21.84 47.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.823 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.496 ' HG ' ' C ' ' A' ' 157' ' ' GLU . 79.0 p -60.44 -35.94 77.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.715 -179.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -64.18 -42.5 96.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.12 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.695 ' C ' ' H ' ' A' ' 164' ' ' GLU . 12.6 p -81.54 178.47 8.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.384 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 65.19 -30.06 0.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.998 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.695 ' H ' ' C ' ' A' ' 162' ' ' THR . 96.1 mt-10 -105.54 55.53 0.69 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.023 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.421 ' O ' ' CG2' ' A' ' 165' ' ' ILE . 11.2 tp -134.76 126.61 47.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.546 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 45.6 m170 44.63 24.71 0.11 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.115 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.406 ' N ' ' C ' ' A' ' 165' ' ' ILE . 47.5 tp10 -95.45 116.29 28.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.495 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.404 ' OD1' ' O ' ' A' ' 167' ' ' GLU . 92.0 m-20 -147.88 64.33 1.11 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.541 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.97 133.22 64.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.49 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.2 tt -131.48 136.11 58.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.572 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -135.36 160.05 69.43 Favored Pre-proline 0 C--O 1.232 0.166 0 CA-C-O 120.806 0.336 . . . . 0.0 110.203 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -69.26 84.94 0.56 Allowed 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.654 2.236 . . . . 0.0 112.182 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 8.1 m -153.15 145.88 24.32 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.436 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -59.96 -49.14 78.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.907 0.384 . . . . 0.0 110.085 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.606 ' O ' ' N ' ' A' ' 177' ' ' ASP . 20.0 mt -122.99 111.01 16.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.955 179.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 27.6 t 44.59 -85.15 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.586 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.606 ' N ' ' O ' ' A' ' 175' ' ' LEU . 28.1 t70 -158.95 49.75 0.35 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.725 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 1.8 pt -127.1 160.26 36.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.572 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -87.82 -6.75 57.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.487 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 106.34 48.0 1.02 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 50.2 m -123.69 2.35 8.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.569 0.223 . . . . 0.0 110.943 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.679 ' C ' ' H ' ' A' ' 184' ' ' HIS . 4.2 t -143.83 -167.52 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.736 0.303 . . . . 0.0 110.514 -179.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.669 ' H ' ' CG1' ' A' ' 182' ' ' VAL . 2.0 mt 62.26 -30.41 0.08 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.915 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.679 ' H ' ' C ' ' A' ' 182' ' ' VAL . 29.7 p80 -58.24 -45.32 87.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.644 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.594 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 78.2 p -62.6 -41.77 99.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.398 -179.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -61.97 -45.25 94.47 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.099 0.476 . . . . 0.0 110.867 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -66.41 -37.6 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.059 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 57.8 m -60.87 -44.02 97.63 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.209 -0.451 . . . . 0.0 109.913 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -62.64 -38.35 89.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.018 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 3.4 mt -62.17 -39.79 93.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.156 179.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -66.64 -42.47 86.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.007 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -68.69 -35.79 77.66 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.567 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.564 ' HE3' ' CD1' ' A' ' 152' ' ' TYR . 26.9 mtpt -63.34 -46.95 84.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.487 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -72.24 -35.77 68.91 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.286 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.432 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 11.0 mmt85 -64.29 -41.36 96.91 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.626 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 69.8 m -65.47 -45.22 84.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.229 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 90.7 mt -66.33 -44.31 91.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.176 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -65.73 -40.83 92.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.029 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 195' ' ' ARG . 79.3 mt-30 -64.32 -36.68 84.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.23 178.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.98 -51.83 50.04 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 31.0 mt -64.29 -41.63 96.78 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.222 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -63.58 -36.6 84.34 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.668 ' HE ' HG22 ' A' ' 207' ' ' VAL . 0.0 OUTLIER -63.16 -44.16 96.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.72 179.101 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 33.3 mt -62.02 -39.03 90.91 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -61.93 -45.6 92.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.968 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.69 ' O ' ' N ' ' A' ' 210' ' ' GLN . 90.3 mmt-85 -65.76 -42.35 90.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.092 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.684 ' O ' ' N ' ' A' ' 211' ' ' GLY . 77.0 t -64.09 -45.36 96.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.061 0.457 . . . . 0.0 110.319 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -67.47 -28.85 68.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.659 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -101.21 -14.11 17.84 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.712 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.69 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.1 tt0 -140.15 -20.32 0.87 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.619 0.247 . . . . 0.0 111.361 -179.031 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.684 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -78.31 23.35 2.82 Favored Glycine 0 N--CA 1.461 0.339 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.598 ' CG ' ' N ' ' A' ' 213' ' ' SER . 71.7 t80 -52.26 175.45 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.611 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.598 ' N ' ' CG ' ' A' ' 212' ' ' TYR . 29.4 t -56.27 132.77 51.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.018 -179.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.455 ' CG2' ' N ' ' A' ' 215' ' ' GLU . 90.4 m -148.2 164.81 32.83 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.772 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . 0.455 ' N ' ' CG2' ' A' ' 214' ' ' THR . 5.4 pt-20 -128.35 101.92 6.43 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.143 -0.481 . . . . 0.0 109.875 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . 0.546 ' C ' ' H ' ' A' ' 218' ' ' PHE . . . 178.15 -79.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.629 -179.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 64.13 -15.37 0.08 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.006 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.546 ' H ' ' C ' ' A' ' 216' ' ' ALA . 51.6 m-85 -147.57 -50.23 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.35 -0.54 . . . . 0.0 112.291 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 220' ' ' GLU . 82.0 tt0 -62.99 -105.96 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.815 -179.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 219' ' ' GLU . 2.8 mt-10 55.36 153.59 0.06 OUTLIER Pre-proline 0 N--CA 1.472 0.64 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.675 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -83.12 81.79 2.28 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 122.201 1.934 . . . . 0.0 112.07 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -147.28 -98.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.968 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 7.5 p -60.52 -46.04 96.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.659 0 CA-C-O 121.154 0.502 . . . . 0.0 110.801 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.431 HD12 ' CZ ' ' A' ' 250' ' ' PHE . 0.7 OUTLIER -63.41 -35.64 73.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.818 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -62.09 -41.87 98.63 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.067 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 9.6 mt -59.39 -40.58 87.01 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 46.6 m0 -60.48 -43.98 96.39 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.04 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 3.6 mt -68.9 -43.82 74.45 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.331 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -39.64 -37.68 0.53 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.396 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -70.17 -45.87 65.84 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.173 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 91.6 p -80.11 -6.88 58.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.394 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -67.26 -121.28 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.376 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.38 69.58 0.22 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 110.544 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . 0.523 ' N ' ' CD2' ' A' ' 235' ' ' LEU . 3.4 mm? -100.76 -171.91 2.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.711 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 10.9 p -82.97 163.15 21.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.699 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -63.79 -46.89 83.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.892 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.51 -43.13 95.06 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.556 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . 0.525 ' OE1' ' N ' ' A' ' 323' ' ' LEU . 47.2 tp10 -63.74 -36.29 83.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.79 -45.31 94.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.384 -179.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -64.24 -47.49 79.46 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.89 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.56 -41.98 99.25 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.816 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.498 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.23 -43.95 93.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.437 178.904 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -47.5 85.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.211 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.91 -46.97 79.45 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.354 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -56.44 -53.13 61.0 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.292 0.568 . . . . 0.0 110.382 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.443 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.03 -40.3 97.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.573 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 64.1 tttp -50.47 -45.46 56.21 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.76 -41.83 91.6 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.221 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . 0.551 ' CG ' ' N ' ' A' ' 251' ' ' GLU . 0.0 OUTLIER -58.64 -51.45 69.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.447 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.551 ' N ' ' CG ' ' A' ' 250' ' ' PHE . 11.6 pt-20 -59.59 -37.5 78.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.04 95.77 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.525 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.3 -46.22 87.73 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.41 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -64.64 -38.7 83.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -60.34 -44.91 95.09 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.515 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -61.63 -43.91 97.98 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . 0.532 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -55.95 -43.97 77.99 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.539 -0.464 . . . . 0.0 109.78 179.226 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . 0.532 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 39.9 t-20 -59.92 -41.16 91.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.237 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -59.0 -47.95 83.37 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.905 0.384 . . . . 0.0 110.296 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -61.8 -37.59 84.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.303 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.408 ' NE2' ' HB ' ' A' ' 297' ' ' THR . 62.1 mm-40 -59.16 -43.84 92.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.307 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -61.61 -47.76 83.98 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.13 0.49 . . . . 0.0 110.041 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -64.27 -35.06 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.03 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 65.3 tp -62.04 -42.99 99.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.201 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.21 -46.2 88.11 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.456 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.13 -43.63 98.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.164 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.55 78.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.251 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . 0.53 ' NE2' ' NE ' ' A' ' 272' ' ' ARG . 24.7 t60 -64.05 -46.1 85.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.318 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.95 -46.15 91.86 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 110.389 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.47 -39.41 90.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.356 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 2.6 tt -60.42 -44.59 95.61 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . 0.53 ' NE ' ' NE2' ' A' ' 268' ' ' HIS . 99.8 mtt180 -60.33 -44.17 95.75 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.21 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -67.77 -39.62 84.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.656 -0.417 . . . . 0.0 110.83 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . 0.426 ' CB ' HH11 ' A' ' 282' ' ' ARG . . . -60.59 -36.81 79.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.007 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.61 -24.5 63.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 0.0 110.364 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 9.0 t -88.32 3.46 49.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.868 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.466 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 11.3 p -61.11 -44.94 99.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.466 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 149.41 -98.44 0.19 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.72 -37.95 89.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.833 0.349 . . . . 0.0 110.164 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.14 46.75 8.93 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -68.72 -32.77 72.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.741 0.305 . . . . 0.0 110.755 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . 0.426 HH11 ' CB ' ' A' ' 274' ' ' ALA . 9.4 ptm180 -91.07 0.96 57.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.995 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 39.2 t -61.49 -46.33 96.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.7 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.5 t -61.74 -44.78 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.139 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 53.1 ttt85 -62.68 -46.8 86.48 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.952 0.406 . . . . 0.0 110.924 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.1 t -63.22 -45.07 93.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -63.9 -39.79 94.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -58.76 -59.58 5.2 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.019 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -64.02 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.866 -0.734 . . . . 0.0 110.044 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -46.19 -54.65 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.897 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.34 82.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.714 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 18.5 tp -59.77 -49.92 75.85 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.809 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.65 -42.0 98.16 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.38 0.61 . . . . 0.0 109.827 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.497 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.9 tt0 -62.91 -36.62 83.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.802 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.96 -42.86 98.13 Favored Glycine 0 CA--C 1.522 0.492 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.2 tpp85 -60.33 -44.47 95.47 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.08 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 35.2 p -58.87 -46.76 87.01 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.436 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -62.5 -45.07 94.7 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.05 0.453 . . . . 0.0 110.338 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -59.5 -39.99 85.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.71 -43.01 99.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.17 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.22 -42.15 97.09 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 61.5 t80 -61.93 -45.53 93.28 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.389 0.614 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 303' ' ' THR . . . . . 0.437 HG23 ' HD1' ' A' ' 307' ' ' HIS . 9.8 m -59.75 -42.58 93.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.763 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.74 -42.91 90.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -54.9 -52.17 63.75 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.571 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 50.1 mttt -62.46 -40.5 96.82 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.93 -0.708 . . . . 0.0 110.996 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.437 ' HD1' HG23 ' A' ' 303' ' ' THR . 7.8 m80 -64.46 -36.32 83.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.188 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.51 -43.74 98.08 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.448 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -66.94 -44.72 79.91 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.672 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -64.41 -48.55 74.97 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.405 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 31.8 mt -63.29 -41.73 99.01 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.523 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 11.5 t -61.0 -43.33 99.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.446 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.21 -51.8 52.23 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 120.931 -0.652 . . . . 0.0 111.682 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -67.2 -41.85 85.12 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.218 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 5.0 mm -63.76 -41.73 93.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.1 p -58.88 -41.22 86.61 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.502 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.4 tpp180 -76.27 -70.13 0.46 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 117.814 -1.555 . . . . 0.0 108.146 176.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 69.01 89.6 0.1 Allowed 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 113.727 -1.578 . . . . 0.0 107.372 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 77.2 mtp85 -69.47 150.23 47.42 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -176.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -69.28 -28.67 66.49 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.915 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -89.86 15.7 9.4 Favored 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 81.78 128.74 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.525 ' N ' ' OE1' ' A' ' 239' ' ' GLU . 94.0 mt . . . . . 0 C--O 1.221 -0.427 0 CA-C-N 113.571 -1.649 . . . . 0.0 111.215 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m 56.37 84.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.014 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 68.5 ttp85 -81.11 140.45 35.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.115 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -49.74 154.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.458 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -127.04 140.54 52.22 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.648 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.445 ' O ' ' CB ' ' A' ' 7' ' ' GLN . 28.7 t-20 -173.78 165.11 4.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.314 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.445 ' CB ' ' O ' ' A' ' 6' ' ' ASN . 3.5 tp60 76.91 90.21 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.833 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -82.0 156.56 17.74 Favored 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 123.018 2.479 . . . . 0.0 112.34 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.705 ' H ' ' CD ' ' A' ' 10' ' ' PRO . 19.9 ttpt -122.52 -38.31 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.413 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.575 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.705 ' CD ' ' H ' ' A' ' 9' ' ' LYS . 26.0 Cg_exo -62.43 147.9 94.15 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.576 2.184 . . . . 0.0 112.238 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.3 p 173.21 67.58 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.613 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.589 ' O ' ' N ' ' A' ' 14' ' ' ARG . 73.4 Cg_endo -74.98 146.59 32.93 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.787 2.325 . . . . 0.0 111.697 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.544 ' C ' ' O ' ' A' ' 12' ' ' PRO . 68.1 tttt 23.29 -86.62 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.333 0.396 . . . . 0.0 110.769 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.589 ' N ' ' O ' ' A' ' 12' ' ' PRO . 84.8 mtt85 -114.54 167.32 10.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.303 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -79.25 -127.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.785 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -160.25 167.41 27.63 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.433 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -153.6 165.19 31.4 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -130.99 143.36 50.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.833 0.349 . . . . 0.0 110.87 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -69.61 -35.3 75.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.575 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 -130.62 157.82 41.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.781 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.679 ' NH2' ' OE2' ' A' ' 53' ' ' GLU . 89.3 mtm-85 -95.85 12.37 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.018 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.448 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 1.2 mpt? -138.03 141.39 40.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.035 0.445 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 20.2 pt-20 -65.48 -43.72 89.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.404 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 14.0 pttm -55.66 -44.62 77.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.2 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.85 -42.38 99.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.025 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -62.93 -41.69 99.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.377 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -60.02 -45.42 92.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.572 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.89 -42.57 99.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.254 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 27.7 t-105 -62.58 -45.96 90.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.384 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -57.54 -43.49 84.45 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.252 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.24 -43.05 99.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.591 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.09 80.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.942 0.401 . . . . 0.0 110.342 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.635 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 76.3 mt-30 -61.65 -38.66 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.349 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.536 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 60.1 ttm-85 -60.57 -42.16 96.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.384 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.0 mt -69.55 -30.15 67.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.732 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.635 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 24.7 m80 65.99 118.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.743 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -138.07 154.46 74.21 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.859 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.31 154.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 122.718 2.279 . . . . 0.0 112.364 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.67 -48.7 0.38 Allowed 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.617 2.211 . . . . 0.0 112.403 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.543 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 71.7 t -61.67 -48.65 87.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.435 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.7 ttp85 -65.04 -41.67 94.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.402 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.47 -42.4 99.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.619 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.82 88.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.414 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.543 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 3.7 mp0 -67.91 -41.22 83.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.652 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.7 tp -61.84 -48.33 81.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.154 0.502 . . . . 0.0 110.622 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.2 -41.44 96.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.59 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -57.92 -48.61 79.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.603 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -55.75 -48.97 74.34 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.94 0.4 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.9 mt -58.25 -39.78 80.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.153 0.501 . . . . 0.0 109.833 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.81 -38.42 85.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.59 HG12 ' O ' ' A' ' 47' ' ' ALA . 37.2 mm -62.3 -42.57 95.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.671 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -57.38 -50.85 71.67 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.471 179.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.679 ' OE2' ' NH2' ' A' ' 21' ' ' ARG . 82.2 tt0 -55.24 -49.25 72.49 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.444 0.64 . . . . 0.0 110.296 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -60.73 -42.74 97.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.314 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -62.02 -38.24 87.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.4 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.45 -49.23 76.93 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.89 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 14.8 mt -61.32 -42.25 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.456 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -41.78 97.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.49 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -60.67 -41.42 95.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.291 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -58.88 -46.01 88.84 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -59.53 -43.29 93.5 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.85 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.05 -37.51 87.47 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.009 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -57.55 -45.6 84.92 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt -61.9 -41.25 97.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.867 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -70.28 -22.09 62.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.314 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.02 38.16 64.01 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 93.4 mt -99.18 -9.44 23.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.758 0.313 . . . . 0.0 110.789 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.46 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 26.7 p-10 -67.36 138.78 57.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.422 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -60.44 -81.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.613 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.411 ' O ' ' OD1' ' A' ' 70' ' ' ASP . 52.2 t0 -154.67 45.92 0.54 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.51 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.408 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 83.01 10.8 82.37 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -70.28 -35.27 73.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.856 0.36 . . . . 0.0 110.332 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -64.75 -52.28 57.81 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.129 0.49 . . . . 0.0 110.583 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 22.4 pt-20 -62.65 -38.94 92.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.979 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.47 -42.31 91.73 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.323 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.8 ttt-85 -63.64 -43.52 96.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -63.73 -42.98 97.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.366 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.82 -44.47 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.192 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.418 ' NE ' ' HA ' ' A' ' 79' ' ' ARG . 3.3 mmp_? -59.83 -42.03 92.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.256 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.44 ' O ' HG13 ' A' ' 84' ' ' ILE . 92.6 m-20 -63.57 -39.85 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.294 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.414 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.83 -48.15 82.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.277 0.561 . . . . 0.0 110.171 -179.491 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.77 -38.16 88.3 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.412 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 53.6 t -63.71 -46.24 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.424 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.9 mt -59.67 -51.32 74.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.473 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.31 -42.47 92.99 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.062 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.51 99.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.809 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -62.83 -49.22 75.76 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.564 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -67.6 -27.76 67.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.032 179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 72.97 25.51 73.53 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.0 mt -91.86 -1.67 57.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.248 . . . . 0.0 110.75 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -61.53 -46.31 90.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.444 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 149.51 170.09 16.65 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.525 ' CG ' ' N ' ' A' ' 94' ' ' LYS . 20.1 ptmt -100.49 -49.11 4.32 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.726 0.298 . . . . 0.0 110.427 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.525 ' N ' ' CG ' ' A' ' 93' ' ' LYS . 10.7 ttmm -148.57 124.26 10.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.617 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.517 ' N ' ' OD1' ' A' ' 95' ' ' ASP . 14.8 p-10 -178.72 103.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.79 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 97' ' ' ARG . . . -65.88 -41.08 92.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.895 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.473 ' O ' ' O ' ' A' ' 96' ' ' ALA . 55.1 ttp180 44.8 100.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.609 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 58.14 -171.49 0.1 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.432 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.504 ' CG2' ' N ' ' A' ' 100' ' ' THR . 4.1 p -134.23 163.51 36.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.517 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.504 ' N ' ' CG2' ' A' ' 99' ' ' VAL . 53.9 p -45.73 168.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.609 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 25.9 t -48.27 105.48 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.817 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -64.72 -41.16 96.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.604 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.0 t 56.5 78.54 0.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.587 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.413 ' C ' ' CD1' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -62.06 -45.39 93.77 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 59.5 m -138.43 -38.01 0.54 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.493 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 144.63 -56.09 0.54 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 45.11 71.25 0.28 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.874 0.369 . . . . 0.0 110.593 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -124.88 123.09 39.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.613 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.515 ' OE1' ' N ' ' A' ' 109' ' ' GLU . 53.8 mp0 -79.11 120.79 24.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.036 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 109' ' ' GLU . 87.5 m-20 -135.24 148.92 49.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.56 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -147.83 -106.97 0.45 Allowed Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.3 mt -112.11 132.72 54.69 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -128.83 -57.13 1.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.398 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.52 136.53 71.34 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.636 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.06 -36.71 66.54 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 122.527 2.151 . . . . 0.0 112.302 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 116' ' ' ARG . 52.1 mtm180 -60.35 -44.8 95.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.692 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.24 -40.26 95.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.013 0.435 . . . . 0.0 110.572 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.554 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 95.7 mt-10 -61.6 -39.41 91.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.573 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.623 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.6 mtmt -61.06 -42.4 98.42 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.409 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.49 -48.02 79.37 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.273 0.559 . . . . 0.0 111.88 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 19.1 t-105 -61.98 -48.42 80.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.426 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.554 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.6 m-70 -69.26 -29.92 67.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.335 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.623 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.5 tptt -58.58 -52.01 67.48 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.894 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.26 -46.46 49.82 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -52.0 -47.43 64.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.669 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.2 m -82.87 -43.98 15.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.863 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.574 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 20.6 m -44.53 -28.92 0.64 Allowed 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.155 -178.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -158.29 -96.84 0.12 Allowed Glycine 0 N--CA 1.46 0.284 0 C-N-CA 119.626 -1.273 . . . . 0.0 111.356 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.54 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.7 mttt -155.98 21.3 0.38 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.745 ' HA ' ' HG3' ' A' ' 134' ' ' GLU . 2.9 m-85 -62.45 49.44 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.907 -178.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.54 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.0 OUTLIER -112.39 110.77 21.17 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.378 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 133.31 -98.8 0.35 Allowed Glycine 0 CA--C 1.53 0.988 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.816 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.2 mm-40 -81.85 -44.05 17.41 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.495 -0.415 . . . . 0.0 111.31 -179.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.857 ' CD ' ' H ' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -63.73 -46.11 86.85 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 130' ' ' PHE . 0.5 OUTLIER -62.44 -41.9 99.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.097 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -62.98 -37.1 85.79 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.468 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 59.3 mttp -61.69 -43.11 99.49 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.324 0.583 . . . . 0.0 109.839 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.445 ' N ' HD22 ' A' ' 138' ' ' LEU . 2.7 mm? -59.47 -43.68 93.18 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.95 -37.38 87.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.619 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -51.38 -42.07 61.12 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.584 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 6.0 mp0 -68.55 -45.47 72.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.374 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -56.6 -52.74 63.69 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.357 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.59 -39.94 89.94 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.238 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.8 m170 -55.5 -40.87 72.29 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.481 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -64.97 -41.72 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.786 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -60.19 -48.89 79.81 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.763 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 18.5 pt-20 -70.93 -46.28 62.73 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.512 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.471 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 68.1 mttm -61.57 -43.2 99.3 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.542 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 43.4 t -64.65 -43.84 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.731 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.596 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.2 m170 -62.7 -36.18 82.13 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.452 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.04 -48.04 75.25 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.55 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -67.96 -42.17 81.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.933 0.397 . . . . 0.0 110.432 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -69.45 -45.87 68.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.015 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.596 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 71.6 t -62.71 -46.47 96.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.064 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 26.3 mt -63.7 -43.97 95.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.575 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.44 ' O ' ' OG ' ' A' ' 160' ' ' SER . 31.9 mt -63.98 -43.45 95.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.605 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . 0.615 ' OE1' ' N ' ' A' ' 157' ' ' GLU . 0.3 OUTLIER -67.42 -29.47 68.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 109.882 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 59.0 m -66.38 -52.18 49.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.006 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.9 pp -79.85 -22.06 43.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.944 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 31.2 m -72.35 -20.09 61.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.976 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.539 ' CG ' ' N ' ' A' ' 162' ' ' THR . 35.0 ptt180 -58.08 -46.77 84.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.161 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.539 ' N ' ' CG ' ' A' ' 161' ' ' ARG . 1.1 p -102.69 24.38 10.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.937 0.399 . . . . 0.0 110.537 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -117.87 -10.76 10.39 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.709 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.477 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 74.9 tt0 -112.1 35.17 3.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.77 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.576 ' O ' ' ND1' ' A' ' 166' ' ' HIS . 3.8 tp -134.8 129.33 51.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.833 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.576 ' ND1' ' O ' ' A' ' 165' ' ' ILE . 12.2 m80 -168.25 25.0 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.331 0.586 . . . . 0.0 109.43 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 45.24 24.04 0.13 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.549 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.447 ' CG ' ' O ' ' A' ' 166' ' ' HIS . 7.2 p30 173.98 110.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.548 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . 0.406 ' O ' ' HB ' ' A' ' 170' ' ' ILE . 56.9 t -139.99 91.14 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.808 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . 0.435 ' CG2' ' O ' ' A' ' 170' ' ' ILE . 16.2 tt 177.41 98.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.753 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -162.16 156.8 19.17 Favored Pre-proline 0 N--CA 1.454 -0.253 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.212 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.9 108.76 2.79 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.527 2.152 . . . . 0.0 111.97 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.673 ' OG ' ' N ' ' A' ' 177' ' ' ASP . 2.3 t -154.42 135.19 13.65 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.597 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -65.51 -43.38 90.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.46 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 2.4 tt -152.5 79.2 1.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.067 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 177' ' ' ASP . 43.9 p 48.02 37.54 7.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.524 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.673 ' N ' ' OG ' ' A' ' 173' ' ' SER . 37.5 t70 58.63 133.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.514 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 11.3 mm -99.79 126.18 53.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.394 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 4.7 tttp -164.51 21.56 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.586 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.51 ' O ' ' O ' ' A' ' 181' ' ' SER . . . 113.96 -138.07 14.6 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.51 ' O ' ' O ' ' A' ' 180' ' ' GLY . 8.7 p 46.86 103.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.875 0.369 . . . . 0.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.452 ' O ' ' HG ' ' A' ' 183' ' ' LEU . 2.5 t -58.93 138.58 19.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.353 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 182' ' ' VAL . 1.6 mt -179.05 -12.76 0.0 OUTLIER 'General case' 0 C--O 1.242 0.662 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.821 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.437 ' ND1' ' N ' ' A' ' 184' ' ' HIS . 2.4 m-70 -58.5 -41.03 84.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.996 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 89.7 p -59.96 -42.89 95.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.817 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -60.9 -45.37 94.88 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.546 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -59.9 -39.61 85.98 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.082 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 58.9 m -61.48 -43.76 98.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.197 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -57.88 -42.11 83.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.971 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.473 ' N ' HD12 ' A' ' 190' ' ' LEU . 10.6 mp -62.27 -45.08 94.87 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.597 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.487 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.11 -39.16 82.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.094 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 5.2 tm-20 -67.97 -46.05 72.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.084 0.469 . . . . 0.0 111.638 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.457 ' HG2' ' H ' ' A' ' 194' ' ' LEU . 17.6 pttt -74.6 -44.5 50.39 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.325 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.525 ' HG ' ' N ' ' A' ' 195' ' ' ARG . 0.4 OUTLIER -67.15 -41.01 86.77 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.939 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.525 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -67.27 -35.58 79.79 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.603 ' O ' ' HG3' ' A' ' 199' ' ' GLN . 73.8 m -62.25 -40.74 97.18 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.7 -44.26 89.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.357 0.599 . . . . 0.0 109.723 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -64.18 -47.46 79.74 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.436 0.636 . . . . 0.0 110.389 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.603 ' HG3' ' O ' ' A' ' 196' ' ' SER . 0.0 OUTLIER -64.58 -29.62 70.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.052 179.514 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -64.6 -43.56 96.29 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 28.2 mt -63.6 -41.88 98.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.045 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.523 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.23 -36.21 83.35 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.368 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.4 -41.86 99.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.508 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.9 mt -61.43 -40.54 94.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.294 179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.424 ' O ' ' OG ' ' A' ' 208' ' ' SER . 79.4 mtt85 -63.45 -41.13 98.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.959 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.719 ' O ' ' N ' ' A' ' 210' ' ' GLN . 78.9 mtp85 -64.13 -38.94 92.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.288 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.588 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -64.17 -43.11 97.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.024 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.443 ' HG ' ' N ' ' A' ' 209' ' ' HIS . 78.0 p -62.97 -37.31 86.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.683 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . 0.443 ' N ' ' HG ' ' A' ' 208' ' ' SER . 24.1 m170 -94.61 -38.46 10.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.379 -179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.719 ' N ' ' O ' ' A' ' 206' ' ' ARG . 39.6 tt0 -93.89 -32.97 13.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.739 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.588 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -88.84 28.04 6.83 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -59.03 -49.44 77.88 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.69 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.446 ' O ' ' O ' ' A' ' 214' ' ' THR . 1.3 t -178.62 108.62 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.478 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.475 ' O ' ' OE1' ' A' ' 215' ' ' GLU . 7.0 p 52.36 108.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.245 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . 0.478 ' HG3' ' H ' ' A' ' 216' ' ' ALA . 5.8 tp10 -167.42 -166.84 0.82 Allowed 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.171 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . 0.478 ' H ' ' HG3' ' A' ' 215' ' ' GLU . . . 62.59 62.07 1.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.722 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.646 ' O ' ' N ' ' A' ' 219' ' ' GLU . 79.5 mm-40 -147.98 36.96 0.86 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.317 -179.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -42.69 82.73 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 120.598 0.237 . . . . 0.0 110.623 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' A' ' 217' ' ' GLU . 6.1 pt-20 172.36 -25.65 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.765 179.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 221' ' ' PRO . 0.5 OUTLIER -59.31 178.67 0.22 Allowed Pre-proline 0 N--CA 1.466 0.353 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.619 -179.315 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 220' ' ' GLU . 59.3 Cg_endo -84.11 88.42 1.06 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.597 2.198 . . . . 0.0 112.801 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -141.25 -105.65 0.15 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.441 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.422 ' CG1' ' N ' ' A' ' 224' ' ' ILE . 14.9 p -61.74 -46.6 96.17 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 CA-C-O 121.79 0.805 . . . . 0.0 110.046 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.422 ' N ' ' CG1' ' A' ' 223' ' ' VAL . 0.2 OUTLIER -61.56 -32.86 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.672 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . 0.572 ' O ' HD23 ' A' ' 229' ' ' LEU . 56.1 t0 -64.25 -40.56 96.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.541 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.6 tp -56.04 -42.42 76.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . 0.454 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 27.5 m0 -62.65 -33.92 76.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.736 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . 0.65 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 92.7 m-20 -59.31 -39.12 82.06 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.572 HD23 ' O ' ' A' ' 225' ' ' ASP . 4.1 mm? -65.67 -40.27 92.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.725 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.531 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -25.42 -66.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.301 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.65 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 0.3 OUTLIER -25.48 -87.48 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.726 179.862 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 58.9 m -79.26 45.95 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.738 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -139.51 81.59 1.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.835 0.35 . . . . 0.0 110.54 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 60.38 59.54 2.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.374 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 76.8 mt -141.13 157.57 45.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.997 0.427 . . . . 0.0 110.783 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 74.8 p -83.34 -162.35 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.674 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . 0.507 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 34.9 p-10 -91.75 -53.72 4.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.101 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . 0.507 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 63.8 mttp -61.02 -45.59 94.18 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.25 0.547 . . . . 0.0 110.689 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -62.16 -27.17 68.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.556 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.26 -46.1 85.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.589 -179.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -66.99 -44.05 81.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.363 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -57.96 -51.1 71.06 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.337 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.456 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.97 -45.02 95.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.51 179.424 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.4 ttt-85 -51.85 -57.53 9.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.403 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -62.08 -35.54 78.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.675 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.23 -53.02 63.02 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.23 0.538 . . . . 0.0 110.445 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.2 mm? -63.21 -41.42 99.14 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.728 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.56 -37.63 78.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.386 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -65.48 -65.01 0.73 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.493 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . 0.565 ' CE2' ' CE1' ' A' ' 307' ' ' HIS . 76.2 m-85 -60.46 -40.75 92.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.701 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.542 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.9 tp10 -57.9 -42.04 83.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.285 0.564 . . . . 0.0 109.883 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.33 -35.75 80.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.236 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -60.88 -47.63 85.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.834 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.46 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.2 tt -65.36 -38.13 81.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.174 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.79 -48.36 80.99 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 121.213 0.53 . . . . 0.0 110.468 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.03 -41.46 99.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.065 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . 0.523 ' NE2' ' CD ' ' A' ' 261' ' ' GLN . 0.0 OUTLIER -56.71 -46.16 81.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.955 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . 0.501 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 49.7 t30 -60.13 -40.99 91.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.24 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . 0.457 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -57.66 -45.08 86.02 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.258 0.552 . . . . 0.0 109.859 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.02 -37.01 85.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.292 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.523 ' CD ' ' NE2' ' A' ' 257' ' ' HIS . 82.2 mt-30 -58.23 -44.17 88.12 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.205 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.63 -47.25 86.25 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.115 0.483 . . . . 0.0 109.811 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . 0.457 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 5.5 mp0 -65.33 -31.89 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.021 179.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.04 -42.52 99.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.108 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 -65.99 -49.02 69.29 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.142 0.496 . . . . 0.0 110.474 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.62 -43.32 98.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.09 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.25 81.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.083 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -61.14 -48.41 81.76 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.25 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.93 -45.07 95.32 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.132 0.491 . . . . 0.0 110.398 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.15 -39.73 91.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.398 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.35 -43.75 96.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.037 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -60.31 -43.5 96.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.079 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -67.88 -40.76 83.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.826 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.33 86.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.948 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -55.84 -22.62 26.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.455 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 17.2 m -61.83 -39.06 90.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.65 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 77.9 t -60.85 -45.47 98.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.605 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 108.84 -6.79 33.14 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -55.34 99.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.81 0.338 . . . . 0.0 110.496 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.7 -40.24 95.71 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.41 -46.32 89.14 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.729 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -68.94 -41.9 77.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.808 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.35 -45.28 96.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 32.4 m -60.69 -45.86 92.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.058 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.86 -43.82 87.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.537 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 42.3 t -62.42 -43.66 98.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.585 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -64.26 -40.21 95.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.694 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -60.53 -51.49 69.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.162 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -66.02 -34.24 77.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.105 179.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -57.39 -52.05 66.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.601 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.67 -38.41 83.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 2.2 tp -61.64 -46.91 87.76 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.237 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 41.9 tp -64.22 -42.85 96.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.202 0.525 . . . . 0.0 110.102 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.519 ' O ' ' OG1' ' A' ' 297' ' ' THR . 2.3 tm-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.79 -42.47 99.75 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -60.76 -43.54 97.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.473 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.519 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 76.7 p -58.97 -47.18 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.076 0.465 . . . . 0.0 110.358 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -62.35 -44.39 96.58 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.488 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -62.43 -37.5 86.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.022 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -44.18 97.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.983 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.51 96.28 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . 0.528 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 51.0 t80 -60.82 -45.83 92.93 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.245 0.545 . . . . 0.0 110.372 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.1 m -61.37 -44.75 96.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.461 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.96 -42.24 88.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.112 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.82 -54.92 40.89 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.058 0.456 . . . . 0.0 110.663 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . 0.528 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 75.4 mttt -61.22 -41.35 96.71 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.19 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.565 ' CE1' ' CE2' ' A' ' 250' ' ' PHE . 2.6 t-80 -64.76 -31.17 72.27 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.26 -48.35 81.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.178 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.62 -42.47 86.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.712 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.9 -47.21 85.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . 0.4 HD11 ' HD1' ' A' ' 307' ' ' HIS . 26.8 mt -64.12 -40.51 96.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.74 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.1 t -59.7 -44.68 93.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.11 61.8 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -62.43 -45.6 92.37 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -70.34 -40.52 77.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.133 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.8 t -44.37 -48.08 9.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.055 0.455 . . . . 0.0 110.156 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.473 ' CD ' ' O ' ' A' ' 319' ' ' ARG . 12.5 ptp85 -94.45 -23.84 17.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.036 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 54.66 51.09 14.52 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.473 ' O ' ' CD ' ' A' ' 317' ' ' ARG . 10.7 mtm-85 178.68 104.36 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.246 0.546 . . . . 0.0 111.775 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -155.18 -40.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.331 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.618 ' CG ' ' H ' ' A' ' 322' ' ' GLU . 15.9 p-10 -150.61 -67.8 0.19 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.433 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.618 ' H ' ' CG ' ' A' ' 321' ' ' ASN . 50.0 mt-10 -132.81 74.37 1.57 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.293 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.414 ' N ' ' CD2' ' A' ' 323' ' ' LEU . 2.1 pt? . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.135 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 40.8 p90 . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 p -151.92 157.09 41.33 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.534 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -107.81 0.55 22.26 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.622 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -116.24 25.55 10.57 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.792 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -62.22 -40.15 95.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.142 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -66.38 155.38 37.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.304 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.701 ' H ' ' CD ' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -158.6 -41.65 0.0 OUTLIER Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.494 -179.666 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.701 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 25.1 Cg_exo -62.71 145.48 95.02 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 122.835 2.356 . . . . 0.0 112.409 -179.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.2 mtmt -99.09 125.5 41.47 Favored Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.88 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -51.94 -39.63 68.68 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 122.128 1.886 . . . . 0.0 112.222 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.568 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.2 OUTLIER -175.01 -44.28 0.0 OUTLIER Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.604 179.582 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.568 ' CD ' ' N ' ' A' ' 11' ' ' SER . 12.7 Cg_exo -67.09 149.42 82.29 Favored 'Trans proline' 0 N--CA 1.51 2.471 0 C-N-CA 123.199 2.599 . . . . 0.0 113.674 -178.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.49 121.0 29.36 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.853 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -64.54 -43.58 93.54 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.865 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -160.31 173.99 14.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.222 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.4 p -69.35 165.52 20.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.417 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -51.63 178.11 0.07 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.566 ' O ' ' N ' ' A' ' 20' ' ' PHE . 79.6 mm-40 -118.4 142.99 46.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.825 0.345 . . . . 0.0 110.368 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.471 ' OE1' ' OD1' ' A' ' 26' ' ' ASN . 94.2 mt-10 46.1 -84.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.094 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.566 ' N ' ' O ' ' A' ' 18' ' ' GLU . 93.9 m-85 -125.26 177.26 6.23 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.807 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -89.61 10.99 21.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.971 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.3 mmm -142.89 141.39 31.51 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 111.062 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -63.86 -35.6 81.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.39 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -59.69 -47.96 83.56 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.017 0.437 . . . . 0.0 110.458 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.65 -37.88 88.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.47 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.471 ' OD1' ' OE1' ' A' ' 19' ' ' GLU . 48.9 t-20 -63.32 -40.72 98.12 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.347 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.61 -44.27 96.73 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.604 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.91 -42.61 99.29 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.049 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -61.56 -43.66 98.45 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.222 0.534 . . . . 0.0 110.459 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -58.4 -44.52 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.047 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.52 -41.32 97.15 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.523 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.97 87.24 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.055 0.455 . . . . 0.0 110.224 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.42 -38.03 88.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.285 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -60.3 -43.15 96.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.313 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -65.0 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.227 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 66.27 112.13 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.817 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.1 mt -132.43 154.73 81.67 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.798 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -39.41 158.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.396 0 C-N-CA 122.768 2.312 . . . . 0.0 112.264 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -68.72 -46.57 1.7 Allowed 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 122.621 2.214 . . . . 0.0 112.3 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.96 -47.73 91.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.53 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -65.64 -39.2 91.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.349 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.85 -43.65 98.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.712 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -41.54 95.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.421 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -67.17 -45.19 77.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.98 -49.88 72.95 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.157 0.503 . . . . 0.0 110.641 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -60.96 -40.55 93.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.247 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.64 -40.66 92.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.374 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.07 -47.99 83.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.51 -40.31 96.34 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.543 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -58.29 -45.61 87.61 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.154 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -62.99 -42.61 97.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -51.89 -42.42 62.71 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -64.32 -44.52 91.3 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.783 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.401 ' O ' ' HD3' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -61.61 -44.76 96.4 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.44 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -61.27 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.483 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -57.79 -49.14 77.63 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.815 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -61.27 -42.27 98.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.334 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.53 -46.46 88.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.558 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.8 t90 -57.75 -40.6 80.09 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -58.74 -46.3 87.71 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.939 179.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -60.67 -44.63 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.424 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.47 ' CD2' ' HZ1' ' A' ' 73' ' ' LYS . 8.1 mp -61.51 -41.47 97.36 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.001 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.17 -39.27 85.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.27 -43.78 98.32 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -71.59 -21.8 61.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.541 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 88.94 15.45 59.34 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 111.291 -0.723 . . . . 0.0 111.291 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.5 mt -63.42 -41.3 98.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.689 0.28 . . . . 0.0 110.767 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.508 ' O ' ' OD1' ' A' ' 68' ' ' ASP . 52.9 p30 -60.53 145.88 46.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.382 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -83.42 -84.98 0.13 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.628 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -115.55 20.8 14.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.97 21.32 50.55 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -57.32 -38.3 73.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.798 0.332 . . . . 0.0 110.278 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.47 ' HZ1' ' CD2' ' A' ' 62' ' ' LEU . 99.3 mttt -61.35 -45.58 93.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.138 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 tp10 -60.28 -40.28 89.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.004 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.56 91.55 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -62.78 -36.58 83.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.439 ' C ' ' CD2' ' A' ' 77' ' ' LEU . 7.8 tt -61.78 -47.36 85.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.351 179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -44.85 96.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.269 0.557 . . . . 0.0 109.75 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -57.4 -42.92 83.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.946 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.445 ' O ' HG13 ' A' ' 84' ' ' ILE . 50.4 t30 -62.56 -39.64 94.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.597 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -49.5 76.67 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.765 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -64.0 -39.41 94.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.223 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.1 t -61.49 -45.37 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.454 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.6 mt -59.2 -50.72 78.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.246 -179.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.13 -40.9 95.08 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.839 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.63 94.38 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.904 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 47.7 tttp -63.88 -47.94 78.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.629 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.2 -23.3 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.951 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 70.22 27.47 72.8 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt -88.68 -2.23 58.49 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.873 0.368 . . . . 0.0 110.458 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -59.27 -84.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.342 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 125.1 -159.69 19.71 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt 57.45 68.68 0.82 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.816 0.341 . . . . 0.0 110.847 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -63.34 -44.95 93.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.05 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.7 p-10 -167.77 -177.62 3.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.446 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -111.56 129.85 55.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.51 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -167.67 125.04 1.17 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.397 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -150.12 19.97 0.87 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.33 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.7 m -125.49 132.9 70.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.904 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.41 115.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.321 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.1 m -128.58 153.52 47.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.453 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -137.18 129.25 29.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.679 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.0 t -67.15 143.21 56.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.475 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.565 ' O ' ' N ' ' A' ' 106' ' ' GLY . 9.7 mp -76.99 149.22 35.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.621 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.3 p 47.3 -84.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.81 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.565 ' N ' ' O ' ' A' ' 104' ' ' LEU . . . 75.22 28.05 62.81 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 20.6 p -97.79 5.8 48.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.792 0.329 . . . . 0.0 110.666 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -63.84 145.23 56.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.649 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -111.15 155.45 22.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.627 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -65.56 -85.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.535 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 144.43 -80.34 0.23 Allowed Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.591 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 14.9 mt -131.64 138.8 48.91 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.815 0.341 . . . . 0.0 111.04 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -91.58 -26.77 18.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.529 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -70.84 123.74 89.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.585 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.83 -24.19 40.62 Favored 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.18 1.92 . . . . 0.0 112.441 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -65.96 -42.93 89.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.626 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.9 mp -85.02 -28.11 25.94 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.8 0.333 . . . . 0.0 110.812 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.616 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 54.2 mt-10 -64.05 -33.94 76.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.978 0.418 . . . . 0.0 110.648 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.587 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 67.9 mmtt -59.79 -46.91 87.74 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.448 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 31.0 mt -69.09 -47.45 65.2 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.428 ' C ' ' CD1' ' A' ' 121' ' ' TRP . 9.7 t-105 -59.71 -48.7 80.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.247 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.616 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 8.7 m-70 -69.68 -31.16 69.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.207 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.9 tptt -57.19 -51.19 70.33 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.806 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.38 -47.23 51.04 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 119.453 -0.899 . . . . 0.0 110.744 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 48.7 tttm -53.33 -51.03 63.72 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.816 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -74.54 -42.68 58.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.358 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -44.41 -27.81 0.48 Allowed 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.28 -96.46 0.11 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 119.609 -1.281 . . . . 0.0 111.506 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.685 ' O ' ' N ' ' A' ' 131' ' ' SER . 57.4 mttp -155.14 24.73 0.42 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.463 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.4 m-30 -59.48 50.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.451 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.685 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.8 m -107.52 113.26 26.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.199 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 120.98 -97.04 0.62 Allowed Glycine 0 CA--C 1.526 0.774 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.828 178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.491 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 5.6 mp0 -74.41 -43.99 53.87 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.441 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.602 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 51.8 mp0 -63.0 -51.88 65.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.32 -40.26 95.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.935 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -61.66 -41.21 97.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.7 mttt -62.36 -44.05 97.39 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.05 0.452 . . . . 0.0 110.322 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mt -59.53 -43.73 93.38 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.544 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.2 OUTLIER -67.88 -33.82 75.48 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.562 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 71.7 mtp85 -53.93 -45.48 71.25 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 118.866 -1.134 . . . . 0.0 108.131 178.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.51 -37.19 71.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.604 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.544 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.6 m-85 -58.64 -58.16 9.78 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.821 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.97 -41.47 98.05 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.413 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.562 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 48.1 m170 -56.02 -42.62 76.76 Favored 'General case' 0 N--CA 1.46 0.065 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.678 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.496 ' O ' ' CG2' ' A' ' 149' ' ' VAL . 9.5 m-70 -65.82 -39.99 91.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.787 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.439 ' O ' HG21 ' A' ' 149' ' ' VAL . 51.2 mtpt -59.43 -45.29 91.97 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.257 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -71.54 -46.86 58.38 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.625 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 68.2 mttm -62.69 -46.04 89.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.751 0.31 . . . . 0.0 111.282 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.496 ' CG2' ' O ' ' A' ' 145' ' ' HIS . 17.7 m -65.77 -37.85 80.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.597 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.603 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.2 m170 -65.28 -41.58 94.03 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.74 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.82 -45.26 93.44 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.631 ' CE1' ' NZ ' ' A' ' 193' ' ' LYS . 23.1 m-85 -69.54 -47.31 64.12 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -65.62 -40.79 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.643 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.603 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 56.6 t -64.05 -43.7 97.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.711 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.32 -44.54 96.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.448 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.487 ' O ' ' OG ' ' A' ' 160' ' ' SER . 18.4 mt -64.24 -43.78 93.85 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.848 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -70.33 -23.52 62.83 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.945 0.403 . . . . 0.0 110.025 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' THR . . . . . 0.607 ' O ' ' OG1' ' A' ' 162' ' ' THR . 52.0 m -73.24 -49.94 25.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.983 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.449 HD12 ' N ' ' A' ' 160' ' ' SER . 3.4 pp -76.57 -30.22 56.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.632 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.487 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 67.5 m -60.66 -48.04 83.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.032 -179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 162' ' ' THR . 19.5 ptp180 -75.42 -45.17 40.47 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.767 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.607 ' OG1' ' O ' ' A' ' 158' ' ' THR . 16.0 p -74.98 170.1 16.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.371 -178.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 65.15 -4.95 0.46 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.11 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.554 ' H ' ' C ' ' A' ' 162' ' ' THR . 97.1 mt-10 -146.25 23.21 1.33 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.342 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.3 tt -57.47 132.42 21.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.428 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.438 ' O ' ' N ' ' A' ' 168' ' ' ASN . 5.9 t-80 -169.47 23.38 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.547 0.689 . . . . 0.0 109.489 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 167' ' ' GLU . 73.7 tt0 42.89 23.18 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.124 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 166' ' ' HIS . 20.8 t30 174.19 103.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.549 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 56.9 t -127.94 130.58 69.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.471 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . 0.511 ' CG2' ' O ' ' A' ' 170' ' ' ILE . 20.3 tt -175.37 84.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.9 179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.02 154.91 18.81 Favored Pre-proline 0 N--CA 1.454 -0.253 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.254 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.43 66.68 2.84 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.562 2.175 . . . . 0.0 111.973 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 23.3 t -150.51 149.4 29.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.686 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -111.03 -43.32 3.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.537 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.51 ' O ' HG13 ' A' ' 178' ' ' ILE . 58.8 tp -145.2 98.54 3.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.206 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 31.2 t 62.12 -83.58 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.228 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -164.67 71.12 0.18 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.954 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 175' ' ' LEU . 2.2 pp -131.89 160.74 42.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.651 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.33 -7.48 50.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.252 179.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 127.6 89.19 0.65 Allowed Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.57 ' O ' ' NE2' ' A' ' 184' ' ' HIS . 60.4 p -117.85 -40.52 2.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.682 0.277 . . . . 0.0 110.679 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.612 ' C ' ' H ' ' A' ' 184' ' ' HIS . 6.3 t -134.21 160.4 41.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.581 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 6.0 tp 65.04 -11.44 0.15 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.689 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.753 ' HD1' ' H ' ' A' ' 185' ' ' SER . 0.0 OUTLIER -63.93 -46.47 84.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.7 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.753 ' H ' ' HD1' ' A' ' 184' ' ' HIS . 79.0 p -68.01 -40.52 82.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.777 -179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -64.0 -46.66 83.57 Favored 'General case' 0 C--O 1.242 0.707 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.746 -178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . 0.639 ' C ' ' ND1' ' A' ' 187' ' ' HIS . 0.1 OUTLIER -71.44 -34.35 70.18 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.977 179.505 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' THR . . . . . 0.625 ' N ' ' ND1' ' A' ' 187' ' ' HIS . 59.6 m -62.26 -44.79 95.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.892 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -61.4 -38.35 86.77 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 10.5 mt -60.96 -41.47 96.39 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.546 -0.462 . . . . 0.0 109.998 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.19 -35.02 77.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.16 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 86.0 tt0 -67.8 -44.93 76.18 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.153 0.501 . . . . 0.0 111.622 -178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.631 ' NZ ' ' CE1' ' A' ' 152' ' ' TYR . 0.0 OUTLIER -71.87 -38.75 69.99 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.064 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.55 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -65.15 -41.9 94.3 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.969 -0.693 . . . . 0.0 110.351 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.493 ' HG2' ' O ' ' A' ' 192' ' ' GLU . 18.8 ptp180 -65.27 -38.14 89.36 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.55 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 79.1 p -60.87 -39.03 87.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 193' ' ' LYS . 97.1 mt -63.72 -42.78 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -58.49 -41.52 85.52 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -60.37 -38.6 84.4 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . 0.407 ' O ' ' HB3' ' A' ' 203' ' ' ARG . . . -60.1 -40.3 96.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 19.8 mt -62.16 -40.59 96.51 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.012 -0.675 . . . . 0.0 109.742 178.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -60.31 -37.42 80.51 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.407 ' HB3' ' O ' ' A' ' 200' ' ' GLY . 5.2 tmm_? -60.84 -41.38 95.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.461 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.18 -38.17 82.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -61.08 -42.54 98.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.284 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 210' ' ' GLN . 5.7 mmp_? -64.48 -36.14 83.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.327 179.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.698 ' O ' ' N ' ' A' ' 211' ' ' GLY . 25.2 t -63.02 -44.95 99.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.194 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.59 -26.79 62.75 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.559 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . 0.426 ' ND1' ' NH1' ' A' ' 206' ' ' ARG . 45.1 t-80 -94.23 -12.93 27.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.372 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.3 tt0 -136.86 -38.33 0.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.093 0.473 . . . . 0.0 110.442 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.698 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -83.4 35.72 2.8 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -45.7 90.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.597 -0.301 . . . . 0.0 110.589 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 32.8 p -158.6 165.24 34.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.361 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.52 HG22 ' H ' ' A' ' 215' ' ' GLU . 0.0 OUTLIER -169.94 -71.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.877 -179.682 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . 0.52 ' H ' HG22 ' A' ' 214' ' ' THR . 79.3 mm-40 47.38 69.73 0.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.852 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -136.18 140.74 43.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.834 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.607 ' O ' ' N ' ' A' ' 219' ' ' GLU . 77.8 mm-40 -117.79 -12.8 10.18 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 121.034 -0.267 . . . . 0.0 111.671 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.534 ' CG ' ' C ' ' A' ' 217' ' ' GLU . 0.2 OUTLIER 66.03 -57.3 0.35 Allowed 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -177.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.607 ' N ' ' O ' ' A' ' 217' ' ' GLU . 37.8 tt0 -125.29 -146.52 0.35 Allowed 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.145 -1.389 . . . . 0.0 108.007 179.183 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.569 ' H ' ' HG2' ' A' ' 219' ' ' GLU . 16.9 tp10 63.43 125.41 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -48.02 121.21 5.66 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 121.38 1.387 . . . . 0.0 112.811 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 178.69 -102.52 0.0 OUTLIER 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.146 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.62 -48.93 86.51 Favored 'Isoleucine or valine' 0 C--O 1.249 1.035 0 CA-C-O 121.704 0.764 . . . . 0.0 110.763 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -31.47 53.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.438 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 51.9 t0 -64.36 -37.99 89.46 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.4 tp -59.44 -42.84 92.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 45.9 m0 -60.36 -36.45 78.06 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.045 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 225' ' ' ASP . 94.0 m-20 -59.43 -40.93 88.33 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' A' ' 231' ' ' GLN . 8.8 mp -63.91 -40.67 97.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.321 0.582 . . . . 0.0 109.512 179.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -53.04 -8.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.846 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.542 ' OE1' ' NH2' ' A' ' 244' ' ' ARG . 11.4 tp-100 -62.86 -43.73 98.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.795 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 54.0 p -145.0 16.48 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.576 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -59.67 -49.86 76.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.697 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . 0.515 ' N ' ' ND2' ' A' ' 234' ' ' ASN . 0.1 OUTLIER 177.54 77.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.595 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 96.1 mt -137.19 161.89 34.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.674 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.0 p -72.95 -162.44 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.617 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -92.19 -55.58 3.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -61.93 -41.34 97.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.985 0.421 . . . . 0.0 110.335 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -63.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.81 -43.02 99.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.162 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -64.27 -49.44 71.87 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.856 0.36 . . . . 0.0 110.775 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.44 -39.77 94.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.978 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.5 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -68.01 -42.6 80.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.345 179.089 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . 0.542 ' NH2' ' OE1' ' A' ' 231' ' ' GLN . 59.2 ttm-85 -59.17 -50.17 75.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.976 -178.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.3 -40.61 86.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.791 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -62.07 -46.93 86.95 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.162 0.506 . . . . 0.0 110.415 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 251' ' ' GLU . 1.0 OUTLIER -62.02 -41.68 98.35 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.171 179.49 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.04 -42.88 81.3 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.119 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 13.6 m170 -59.42 -55.79 30.22 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.664 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -63.66 -33.85 76.54 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.694 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 29.3 tp10 -59.72 -43.33 94.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.053 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.44 86.65 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.398 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -59.9 -48.17 82.8 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.705 -179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.402 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.3 tt -66.47 -31.76 55.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.272 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.32 -48.87 79.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.186 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.14 -42.25 99.44 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.372 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -57.64 -42.77 84.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.127 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.56 -40.43 96.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.356 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . 0.403 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 13.7 t-160 -58.38 -48.06 81.83 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.239 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -62.81 -37.08 85.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.482 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.432 ' NE2' HG23 ' A' ' 297' ' ' THR . 0.3 OUTLIER -59.17 -45.5 90.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.789 0.328 . . . . 0.0 110.435 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -61.73 -45.43 93.99 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . 0.403 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.8 mp0 -64.94 -34.92 79.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.988 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.16 -43.12 99.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.335 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -65.31 -48.22 73.84 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.992 0.425 . . . . 0.0 110.66 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 66.5 mt -63.14 -43.33 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.128 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.07 -36.94 83.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.23 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -63.03 -46.59 86.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.378 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.98 -44.55 95.74 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.453 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.41 -42.87 99.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.465 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 2.7 tt -60.72 -43.9 97.28 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.752 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -58.66 -44.75 90.25 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.165 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 -67.75 -36.01 79.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.626 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -62.96 -37.11 85.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.009 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -58.84 -17.06 20.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.396 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 60.4 p -89.3 2.62 54.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.68 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 14.8 p -60.18 -43.48 93.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.677 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.412 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 119.67 -67.86 0.39 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -88.61 116.91 27.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.781 0.324 . . . . 0.0 110.349 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -64.95 116.05 8.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -145.34 -44.62 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.7 0.286 . . . . 0.0 110.408 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . 0.412 ' O ' ' OG ' ' A' ' 286' ' ' SER . 11.6 ptp180 -105.76 -6.18 19.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.457 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.55 -45.8 96.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.528 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 284' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 288' ' ' GLU . 44.5 t -63.49 -51.63 64.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.513 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.82 -44.44 96.83 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.981 0.419 . . . . 0.0 110.853 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 286' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 282' ' ' ARG . 38.6 m -60.32 -42.99 96.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.382 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -63.54 -38.33 90.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.933 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 284' ' ' SER . 76.0 mm-40 -59.89 -61.45 2.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 29.4 mmtt -63.4 -39.71 95.24 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.018 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -45.16 -55.41 5.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.938 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -65.43 -35.69 81.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.679 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 16.5 tp -60.63 -49.04 79.14 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.497 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.67 -41.52 98.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 109.973 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -39.94 95.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -59.99 -50.78 63.99 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . 0.433 ' CZ ' ' OE1' ' A' ' 299' ' ' GLU . 10.6 tpp180 -60.4 -37.79 81.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.909 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.432 HG23 ' NE2' ' A' ' 261' ' ' GLN . 9.1 m -58.91 -48.15 82.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.327 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -63.59 -41.53 98.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.729 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . 0.433 ' OE1' ' CZ ' ' A' ' 296' ' ' ARG . 96.6 mt-10 -58.77 -43.82 90.49 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.138 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.5 -43.99 97.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.393 -0.523 . . . . 0.0 109.906 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.75 -41.9 84.07 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -61.16 -45.88 92.83 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.145 0.498 . . . . 0.0 110.455 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.5 m -60.14 -43.37 95.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.313 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.36 -43.12 93.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.052 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -58.66 -46.12 87.85 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.805 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.99 -42.86 99.96 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.559 179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -65.42 -35.42 80.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.137 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . 0.454 ' O ' ' OG ' ' A' ' 312' ' ' SER . 21.7 mt -62.29 -43.58 98.5 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.362 179.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 19.5 tm0? -65.49 -46.52 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -64.31 -49.02 73.43 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.079 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 33.1 mt -62.86 -42.78 99.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 312' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 51.0 m -60.95 -41.87 97.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.299 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.48 98.22 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.3 -47.99 79.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.773 0.32 . . . . 0.0 110.74 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . 0.481 ' O ' ' C ' ' A' ' 316' ' ' SER . 17.0 mt -77.71 -25.4 14.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 315' ' ' ILE . 42.6 t -33.1 -54.59 0.39 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.742 -179.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.494 HH12 ' CD2' ' A' ' 323' ' ' LEU . 18.2 ptt85 -106.31 -32.6 8.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.484 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 44.0 58.47 3.64 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.063 0.458 . . . . 0.0 109.824 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 54.0 ptt85 -56.77 177.57 0.07 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.323 -179.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -70.62 134.2 47.37 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.097 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 75.27 150.63 0.11 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.042 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -46.48 137.57 6.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.629 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.494 ' CD2' HH12 ' A' ' 317' ' ' ARG . 9.8 mp . . . . . 0 C--O 1.219 -0.523 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.467 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 p -78.4 -4.88 50.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.603 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -62.98 -38.86 92.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.485 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -68.28 143.68 55.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.533 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -126.37 134.9 50.94 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.487 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 57.03 36.06 27.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.431 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.603 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -64.63 -41.14 55.36 Favored Pre-proline 0 C--O 1.231 0.123 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.244 -179.527 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 7' ' ' GLN . 35.1 Cg_exo -59.52 142.6 99.17 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.41 2.073 . . . . 0.0 112.078 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -155.43 149.97 20.06 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.316 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.38 155.45 63.88 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.671 2.247 . . . . 0.0 111.966 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -156.16 64.24 3.66 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.807 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.45 -14.81 22.48 Favored 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 122.751 2.301 . . . . 0.0 112.117 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt 72.56 36.64 0.97 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.627 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -61.93 -41.71 98.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.594 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 62.47 129.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.375 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.2 t -150.08 154.21 37.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.441 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -87.09 129.4 9.46 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -175.51 76.07 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.64 0.257 . . . . 0.0 110.426 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.481 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 55.6 mp0 -70.86 -41.26 71.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.027 0.441 . . . . 0.0 110.841 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -119.87 164.15 16.46 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.778 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -81.1 -15.43 55.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.936 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.04 145.85 51.15 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 121.401 0.62 . . . . 0.0 111.166 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -64.99 -36.51 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.363 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.1 tttp -57.57 -47.93 80.76 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.276 0.56 . . . . 0.0 110.466 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.3 mt -60.8 -39.47 89.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.344 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -63.47 -39.84 95.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -57.41 -48.91 77.86 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.373 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.431 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 4.2 mm? -61.38 -42.82 99.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.23 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.501 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 46.5 t-105 -61.48 -42.35 98.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.266 0.555 . . . . 0.0 110.417 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -57.72 -44.6 86.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.403 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.8 -41.57 95.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.356 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.27 93.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.428 . . . . 0.0 110.427 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.501 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.5 mt-30 -62.46 -39.42 93.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.329 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.24 -40.92 97.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.361 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.02 -39.86 95.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.429 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.64 106.94 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.896 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -129.45 155.06 80.73 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -40.47 154.33 0.06 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.65 2.233 . . . . 0.0 112.245 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.93 -36.07 32.35 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.594 2.196 . . . . 0.0 112.296 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.73 -49.77 75.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.017 0.437 . . . . 0.0 110.747 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -68.25 -39.29 82.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.464 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -63.03 -43.41 98.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.88 -43.67 87.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.634 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.57 -44.26 74.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.765 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.63 -48.4 79.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.565 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -60.88 -41.63 96.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.35 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.61 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.69 -48.79 79.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.734 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -56.37 -47.92 77.9 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.536 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.64 -39.25 83.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.075 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.98 -38.07 84.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.95 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.61 HG12 ' O ' ' A' ' 47' ' ' ALA . 38.6 mm -62.92 -44.38 99.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.899 179.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -58.31 -43.64 88.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.332 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -60.52 -47.48 85.98 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.171 0.51 . . . . 0.0 110.322 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -62.59 -41.33 98.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.693 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -63.87 -37.33 86.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.301 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -62.63 -46.99 85.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.103 0.477 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.1 tp -61.4 -41.32 96.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.995 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.04 -41.99 99.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.532 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -58.96 -43.35 91.3 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.924 0.393 . . . . 0.0 110.275 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.78 -45.87 92.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -57.75 -42.42 83.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.997 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.4 mt -62.53 -42.34 99.46 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.016 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -56.48 -43.65 79.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.63 -39.68 94.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.879 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -63.22 -21.56 66.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.988 179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.75 35.63 3.98 Favored Glycine 0 C--N 1.335 0.473 0 N-CA-C 111.233 -0.747 . . . . 0.0 111.233 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 90.9 mt -123.25 -164.99 1.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.339 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 54.63 95.11 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.521 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -121.67 -39.93 2.59 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.619 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -62.2 -41.17 98.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.643 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 88.41 6.93 73.32 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -60.48 -39.18 86.71 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.345 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.465 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 3.4 mptp? -54.79 -55.87 25.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.914 0.388 . . . . 0.0 110.52 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -57.84 -39.89 78.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.021 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.53 -41.38 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.54 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.465 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 89.7 mtm180 -65.16 -39.98 93.7 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.69 -44.91 92.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.392 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.401 HD13 HG23 ' A' ' 78' ' ' ILE . 96.5 mt -65.53 -45.14 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.238 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -60.63 -43.24 97.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.128 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.402 ' O ' HG13 ' A' ' 84' ' ' ILE . 26.0 t-20 -64.06 -40.13 95.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.58 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.435 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.45 -46.68 88.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.045 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -64.92 -39.87 94.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.588 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.8 t -63.75 -46.5 94.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.432 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.467 HD12 HG22 ' A' ' 84' ' ' ILE . 96.6 mt -60.13 -49.88 82.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.558 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.3 mt -65.09 -40.69 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.062 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.01 -41.1 97.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.795 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -64.77 -46.78 80.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.775 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -76.05 -19.59 58.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.394 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 65.29 26.53 71.7 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.9 mt -97.65 13.42 30.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 110.669 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 92' ' ' GLY . 38.4 p-10 -62.77 -37.64 87.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.69 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.51 ' N ' ' OD1' ' A' ' 91' ' ' ASP . . . 119.47 159.39 10.95 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -138.03 124.39 20.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.912 0.387 . . . . 0.0 110.397 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -144.12 150.53 38.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.89 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.459 ' OD1' ' N ' ' A' ' 96' ' ' ALA . 65.3 t0 -72.32 131.33 42.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.608 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.459 ' N ' ' OD1' ' A' ' 95' ' ' ASP . . . -108.72 125.25 51.7 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.228 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -121.32 -9.72 9.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.854 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -75.64 127.98 34.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.606 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 71.0 t -62.85 -46.87 95.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.738 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.1 t -155.95 153.24 29.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.66 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 66.8 m -105.9 114.62 28.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.284 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -105.1 1.11 28.12 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.653 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 83.9 p -65.9 135.24 54.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.374 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.9 mp 44.52 66.59 0.83 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.211 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.7 t -63.28 -43.19 98.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.73 -179.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 68.83 95.2 0.05 OUTLIER Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 13.1 p -100.72 0.35 38.78 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.736 0.303 . . . . 0.0 110.775 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 57.45 160.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.563 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -148.89 159.28 44.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.636 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.51 ' CG ' ' H ' ' A' ' 111' ' ' GLY . 26.4 t0 -145.57 -172.65 3.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.633 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.51 ' H ' ' CG ' ' A' ' 110' ' ' ASP . . . -62.06 -51.79 54.48 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.422 HD11 ' H ' ' A' ' 112' ' ' LEU . 0.0 OUTLIER -127.12 48.0 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.879 0.371 . . . . 0.0 110.498 -179.732 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.412 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 31.5 p-10 -65.16 -27.75 68.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.444 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -99.39 147.77 33.77 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.452 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.454 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 35.1 Cg_endo -64.79 -24.1 61.95 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.619 2.213 . . . . 0.0 111.87 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.617 ' CZ ' HH21 ' A' ' 205' ' ' ARG . 76.9 ttt-85 -62.98 -46.07 89.45 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.947 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.56 -39.55 77.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.954 0.407 . . . . 0.0 110.663 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.538 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.3 mt-10 -60.51 -39.24 87.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.521 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.571 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.4 mttt -61.0 -44.2 97.77 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.494 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.75 -46.54 84.85 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.943 0.402 . . . . 0.0 111.71 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.425 ' CD1' ' C ' ' A' ' 121' ' ' TRP . 8.7 t-105 -60.0 -47.54 85.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.369 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.538 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.9 m-70 -71.17 -32.97 69.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.429 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.8 OUTLIER -56.59 -51.02 70.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.86 -178.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.63 -46.74 58.22 Favored 'General case' 0 C--O 1.247 0.936 0 C-N-CA 120.017 -0.673 . . . . 0.0 110.596 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -52.97 -45.21 67.69 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.914 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.7 m -85.41 -40.94 15.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.691 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.564 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 13.7 m -44.54 -29.88 0.79 Allowed 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -155.36 -96.59 0.13 Allowed Glycine 0 N--CA 1.463 0.472 0 C-N-CA 119.751 -1.214 . . . . 0.0 111.31 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.731 ' O ' ' N ' ' A' ' 131' ' ' SER . 65.1 mttp -154.51 17.58 0.47 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -57.93 51.04 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.811 -179.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.731 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.5 m -109.13 123.54 49.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.139 0.495 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.61 -97.8 1.2 Allowed Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.142 178.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -74.96 -39.87 61.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.993 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.476 ' O ' HD22 ' A' ' 138' ' ' LEU . 58.5 mp0 -63.45 -52.71 60.28 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.067 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.3 mt -59.8 -39.96 86.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.352 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -61.82 -38.66 88.99 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -63.1 -42.89 99.66 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.444 0.64 . . . . 0.0 109.854 178.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 134' ' ' GLU . 4.2 mm? -59.45 -42.55 92.23 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.21 -37.57 87.94 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -53.54 -41.16 66.15 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 178.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.931 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 79.9 mm-40 -69.66 -47.32 63.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -57.42 -48.75 78.29 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.2 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 95.2 mt -59.76 -41.33 90.78 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.071 -0.651 . . . . 0.0 110.205 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.931 ' ND1' ' O ' ' A' ' 141' ' ' GLU . 1.8 p-80 -55.84 -43.03 76.65 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.024 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.706 ' N ' ' CD2' ' A' ' 144' ' ' HIS . 11.9 m-70 -59.8 -41.98 92.42 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.449 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -62.65 -42.44 99.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.313 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.718 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 96.5 mt-10 -67.59 -44.09 78.95 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.206 0.527 . . . . 0.0 111.297 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.47 -42.24 71.71 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.146 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.99 -50.56 76.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.718 ' CD2' ' O ' ' A' ' 147' ' ' GLU . 0.2 OUTLIER -72.75 -18.89 61.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.25 -179.642 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.671 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 9.7 mm-40 -70.89 -48.69 52.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.502 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 29.2 m-85 -63.77 -41.22 98.02 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.767 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.85 -38.46 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.938 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.554 ' O ' ' HG3' ' A' ' 157' ' ' GLU . 19.3 t -61.25 -46.28 96.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.265 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.1 mt -65.28 -44.88 86.58 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.814 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 156' ' ' LEU . 1.7 mm? -64.31 -43.81 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.064 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 154' ' ' VAL . 0.6 OUTLIER -68.68 -29.67 68.17 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.103 0.477 . . . . 0.0 109.982 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 154' ' ' VAL . 66.1 m -65.36 -48.69 72.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.811 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.477 HD21 HH22 ' A' ' 186' ' ' ARG . 2.3 pp -79.11 -21.12 47.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.762 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.474 ' HG ' ' N ' ' A' ' 161' ' ' ARG . 95.7 p -65.38 -35.88 82.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.826 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.474 ' N ' ' HG ' ' A' ' 160' ' ' SER . 65.9 mtp180 -61.97 -46.36 89.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.293 -179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.72 ' C ' ' H ' ' A' ' 164' ' ' GLU . 2.9 t -100.49 174.22 6.2 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.442 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 62.41 -16.36 0.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.962 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.72 ' H ' ' C ' ' A' ' 162' ' ' THR . 59.3 tt0 -111.38 43.64 1.46 Allowed 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.662 179.708 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.7 tt -134.57 140.45 45.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.066 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.435 ' O ' ' CG ' ' A' ' 167' ' ' GLU . 19.6 t-80 -176.19 24.21 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.435 ' CG ' ' O ' ' A' ' 166' ' ' HIS . 14.3 pt-20 43.3 31.13 0.36 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.891 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -165.78 -66.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.338 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 4.4 t 47.46 71.67 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.739 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . 0.521 ' C ' ' HG ' ' A' ' 171' ' ' SER . 20.5 tt -177.49 126.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.626 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' SER . . . . . 0.521 ' HG ' ' C ' ' A' ' 170' ' ' ILE . 0.2 OUTLIER -162.89 165.44 14.94 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.272 179.711 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.39 139.76 64.3 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.511 2.141 . . . . 0.0 111.952 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 1.6 p -145.96 138.1 25.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.418 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -129.03 -32.64 2.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.517 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.441 ' O ' HG13 ' A' ' 178' ' ' ILE . 51.9 tp -63.06 101.32 0.27 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.509 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' SER . . . . . 0.628 ' O ' ' CG ' ' A' ' 177' ' ' ASP . 0.9 OUTLIER 43.57 35.0 0.89 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.257 179.505 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.628 ' CG ' ' O ' ' A' ' 176' ' ' SER . 4.8 p-10 49.63 24.6 1.22 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 175' ' ' LEU . 2.6 pp -132.95 165.93 30.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.105 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -113.25 131.24 55.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.42 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 140.36 142.65 4.21 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 39.9 t -93.05 -43.46 8.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 110.896 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.546 ' C ' ' H ' ' A' ' 184' ' ' HIS . 60.3 t -129.13 8.15 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.983 0.421 . . . . 0.0 110.825 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 12.0 tp -52.08 -7.11 0.05 Allowed 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.262 0.553 . . . . 0.0 110.875 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.672 ' N ' ' HD1' ' A' ' 184' ' ' HIS . 0.2 OUTLIER -56.35 -39.09 72.31 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.155 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 58.7 p -60.83 -42.34 97.54 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.053 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.477 HH22 HD21 ' A' ' 159' ' ' LEU . 3.0 tpt180 -62.08 -45.3 94.11 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 120.926 0.393 . . . . 0.0 110.642 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -65.69 -38.44 89.26 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.326 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 61.6 m -60.68 -44.85 96.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.073 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.455 ' O ' ' CD ' ' A' ' 193' ' ' LYS . 97.5 mt-10 -61.2 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.077 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 3.5 mt -61.23 -42.05 97.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.351 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.411 ' O ' ' HB3' ' A' ' 195' ' ' ARG . 98.3 mttt -68.84 -29.36 67.67 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 76.3 tt0 -69.94 -50.97 36.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.978 0.418 . . . . 0.0 111.629 -179.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.502 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 1.1 ptmt -71.94 -39.41 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.783 -0.367 . . . . 0.0 111.247 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.574 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.45 -41.45 72.82 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.93 -179.493 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.505 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 50.2 ptt85 -65.87 -37.46 86.2 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 96.0 p -62.73 -41.45 99.19 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 193' ' ' LYS . 91.9 mt -65.72 -43.69 93.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.824 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -63.51 -41.27 98.51 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.685 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.855 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 47.1 mm-40 -63.5 -33.02 74.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.207 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.57 -40.6 90.73 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 37.3 mt -63.74 -43.34 96.76 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.205 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.904 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 9.1 p-10 -65.82 -34.23 77.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.595 0.712 . . . . 0.0 109.213 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.904 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.1 tmt_? -63.43 -42.6 98.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.375 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 49.4 mt -61.18 -39.78 91.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.617 HH21 ' CZ ' ' A' ' 116' ' ' ARG . 33.6 mmt180 -60.19 -43.1 96.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.045 179.337 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.611 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.8 mtm-85 -64.76 -36.79 85.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.391 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.67 ' O ' ' N ' ' A' ' 211' ' ' GLY . 47.2 t -63.17 -46.46 95.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.041 0.448 . . . . 0.0 110.176 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.7 p -74.24 -26.64 60.35 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.928 0.394 . . . . 0.0 110.764 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -95.05 -14.37 24.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.292 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.611 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -138.11 -30.19 0.81 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.043 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.67 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -73.18 15.49 2.49 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.503 ' H ' ' C ' ' A' ' 210' ' ' GLN . 2.5 t80 -64.09 -63.16 1.22 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.967 0.413 . . . . 0.0 110.604 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.451 ' O ' ' OG ' ' A' ' 213' ' ' SER . 0.5 OUTLIER 174.75 81.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.273 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 7.0 p -104.22 -11.88 16.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.63 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 55.68 177.88 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.501 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -106.82 170.21 8.08 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.918 0.39 . . . . 0.0 111.15 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -143.08 30.98 1.4 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.987 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.49 ' O ' ' C ' ' A' ' 219' ' ' GLU . 70.2 m-85 -84.03 157.51 21.79 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.498 0.666 . . . . 0.0 109.687 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.49 ' C ' ' O ' ' A' ' 218' ' ' PHE . 81.9 tt0 -34.59 -48.16 0.35 Allowed 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.114 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.419 ' O ' ' CG1' ' A' ' 223' ' ' VAL . 39.5 tp10 -174.01 126.77 0.44 Allowed Pre-proline 0 C--O 1.225 -0.19 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.811 176.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.631 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 72.6 Cg_exo -43.42 159.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.377 2.051 . . . . 0.0 111.755 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.631 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 65.8 ttp85 95.74 -54.44 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.619 0.575 . . . . 0.0 110.705 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.84 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 4.9 p -55.91 -83.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.598 0 CA-C-O 121.351 0.596 . . . . 0.0 110.878 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.84 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 0.9 OUTLIER -57.1 -24.58 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.036 -179.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -64.36 -47.55 78.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.096 0.474 . . . . 0.0 109.731 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.35 -42.82 99.31 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.77 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . 0.418 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 43.6 m0 -60.88 -36.17 78.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.983 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 228' ' ' ASP . 64.8 t0 -63.74 -38.3 90.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.663 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 231' ' ' GLN . 95.0 mt -62.62 -42.18 99.43 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.1 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.403 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -38.12 -25.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.095 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 229' ' ' LEU . 7.2 tt0 -69.65 -72.47 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.805 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 79.1 p -66.18 -18.49 65.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -57.4 -53.88 53.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.876 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . 0.705 ' ND2' HH21 ' A' ' 319' ' ' ARG . 48.5 t-20 -178.79 -143.11 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.046 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . 0.659 ' H ' ' CG ' ' A' ' 234' ' ' ASN . 36.7 mt 80.32 144.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.661 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 24.1 p -80.57 172.47 13.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 33.0 p-10 -55.86 -44.12 77.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.638 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . 0.467 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.6 -47.99 81.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.011 0.434 . . . . 0.0 110.662 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -65.85 -36.11 82.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.68 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.46 -43.12 98.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.196 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -62.9 -48.97 76.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.477 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.17 -48.69 80.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.504 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -63.64 -39.72 95.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.323 179.283 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -57.44 -50.32 73.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.961 0.41 . . . . 0.0 110.528 -179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.61 -36.26 83.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.563 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -60.13 -51.87 67.77 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.51 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.502 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.12 -40.38 97.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.886 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 79.3 tttt -55.65 -45.4 77.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.196 0.522 . . . . 0.0 110.337 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.86 -37.03 81.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.288 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -61.23 -49.33 77.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.065 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 11.9 pt-20 -62.83 -37.08 85.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.058 0.456 . . . . 0.0 109.851 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.83 87.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.617 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -63.53 -48.97 75.36 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.245 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.5 tt -64.2 -34.17 67.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.26 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -63.05 -48.34 79.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.053 0.454 . . . . 0.0 110.399 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.217 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -55.75 -43.2 76.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.029 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -61.83 -40.47 95.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.088 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -59.16 -47.83 83.85 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.249 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -64.24 -32.91 74.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.378 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -48.69 80.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.861 0.363 . . . . 0.0 110.186 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . 0.445 ' HZ3' HD13 ' A' ' 266' ' ' ILE . 65.6 tttm -61.93 -43.54 98.64 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.27 -36.85 85.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.002 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 41.6 tp -62.4 -42.47 99.45 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.137 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -62.41 -46.05 90.34 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.381 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . 0.445 HD13 ' HZ3' ' A' ' 262' ' ' LYS . 88.0 mt -62.51 -43.48 98.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.3 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.2 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.39 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -61.28 -46.96 88.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.211 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -61.93 -46.15 90.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.37 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -62.0 -39.2 91.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.52 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 1.3 tt -60.11 -44.16 95.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.887 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -63.08 -40.19 96.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.271 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -67.33 -41.61 84.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.759 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -62.6 -41.92 99.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.82 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -56.95 -17.56 10.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.94 0.4 . . . . 0.0 110.539 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.6 t -62.6 -34.09 76.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.542 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.655 HG12 ' H ' ' A' ' 279' ' ' ASP . 8.4 p -59.16 -40.03 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.323 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.447 ' H ' HG13 ' A' ' 277' ' ' VAL . . . 64.94 26.93 71.6 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . 0.655 ' H ' HG12 ' A' ' 277' ' ' VAL . 25.6 t0 -108.19 -8.8 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.318 . . . . 0.0 110.556 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . 0.654 ' C ' ' H ' ' A' ' 282' ' ' ARG . . . 63.99 -141.64 45.28 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 78.2 tt0 58.56 -5.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.495 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . 0.654 ' H ' ' C ' ' A' ' 280' ' ' GLY . 41.9 ttm180 -140.02 -31.07 0.66 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.516 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.83 -44.07 98.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.418 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 39.6 t -60.78 -53.15 60.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.08 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 74.0 mtp85 -60.82 -46.63 89.79 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.913 0.387 . . . . 0.0 111.064 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 19.6 m -59.1 -40.24 84.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -65.78 -39.38 90.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.547 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -58.7 -59.65 5.07 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.28 0.562 . . . . 0.0 110.429 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -63.23 -35.84 81.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.309 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -52.16 -49.04 64.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.045 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.66 -31.93 70.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.258 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 16.8 tp -64.25 -53.29 51.46 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.51 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.0 mp -63.6 -41.53 98.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.012 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -64.77 -39.57 93.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.169 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.15 -45.43 96.57 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . 0.628 ' HE ' ' C ' ' A' ' 296' ' ' ARG . 1.4 tmm_? -63.63 -41.88 98.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.058 0.456 . . . . 0.0 110.14 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.1 m -58.45 -49.59 76.78 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.47 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -40.13 96.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.417 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -58.48 -42.67 88.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -44.31 96.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.919 0.39 . . . . 0.0 110.462 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.28 -45.42 92.77 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -62.11 -41.76 98.55 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.098 0.475 . . . . 0.0 110.463 179.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 14.5 m -61.1 -43.97 98.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.502 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -60.03 -43.21 92.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.96 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -59.16 -48.97 79.63 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.196 0.522 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -61.74 -44.8 96.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.226 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.581 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.8 OUTLIER -63.36 -36.05 82.42 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . 0.471 ' O ' ' OG ' ' A' ' 312' ' ' SER . 0.4 OUTLIER -58.0 -45.42 86.85 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.413 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -71.66 -57.63 4.21 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.272 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.34 -49.58 76.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.55 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 4.4 tp -61.55 -43.03 99.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.506 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 312' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 51.8 p -60.0 -40.54 89.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.15 -38.27 95.06 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.24 -45.0 95.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.78 0.324 . . . . 0.0 110.659 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . 0.657 ' O ' ' N ' ' A' ' 318' ' ' ALA . 4.1 mm -61.0 -100.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.454 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.493 ' C ' ' O ' ' A' ' 315' ' ' ILE . 1.4 m 30.54 -87.11 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.309 0.576 . . . . 0.0 110.264 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.723 ' HG3' ' H ' ' A' ' 319' ' ' ARG . 11.4 ptp85 -59.19 -44.17 92.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.46 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.657 ' N ' ' O ' ' A' ' 315' ' ' ILE . . . 77.45 12.96 1.98 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.44 178.751 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.723 ' H ' ' HG3' ' A' ' 317' ' ' ARG . 94.9 mtt180 -147.72 115.28 6.34 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.137 0.494 . . . . 0.0 111.761 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -157.73 -50.69 0.07 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.319 179.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -135.57 -79.71 0.43 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.208 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -133.5 51.69 2.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.714 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.513 ' O ' ' O ' ' A' ' 318' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.217 -0.644 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.419 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 86.8 t80 . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.2 p -67.62 -48.15 67.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.099 -179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -138.44 151.54 47.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.433 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -114.44 103.04 10.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.248 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -61.6 -38.55 88.02 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.189 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -90.19 142.9 27.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.418 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.76 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -165.35 -45.01 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.823 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.76 ' HD2' ' H ' ' A' ' 7' ' ' GLN . 87.4 Cg_endo -79.99 149.81 20.34 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 122.37 2.047 . . . . 0.0 112.215 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -148.95 146.58 21.87 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.062 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -63.49 147.03 93.46 Favored 'Trans proline' 0 N--CA 1.501 1.941 0 C-N-CA 122.333 2.022 . . . . 0.0 112.048 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.4 p -151.85 140.9 13.92 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.09 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -69.51 148.57 66.99 Favored 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 122.554 2.169 . . . . 0.0 112.42 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -102.89 109.65 21.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.639 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.523 ' O ' ' O ' ' A' ' 15' ' ' GLU . 61.3 ttp180 -138.84 115.33 10.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.263 179.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.523 ' O ' ' O ' ' A' ' 14' ' ' ARG . 78.9 tt0 56.2 132.92 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.911 0.386 . . . . 0.0 110.573 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.5 t -57.55 -95.25 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.473 ' C ' ' OE1' ' A' ' 18' ' ' GLU . . . 80.05 -164.47 48.14 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.473 ' OE1' ' C ' ' A' ' 17' ' ' GLY . 58.6 mp0 48.58 100.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.742 0.305 . . . . 0.0 110.513 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.493 ' H ' HD22 ' A' ' 26' ' ' ASN . 80.2 mm-40 -103.75 -15.01 15.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.788 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -132.7 152.07 51.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.774 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -67.25 -18.77 65.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.88 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.4 mmt -129.6 148.05 51.46 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.295 0.569 . . . . 0.0 111.116 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.669 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 49.7 mp0 -66.42 -40.94 89.86 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.698 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -56.01 -47.79 77.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.121 0.486 . . . . 0.0 110.469 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.59 -39.41 91.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.295 0.569 . . . . 0.0 109.506 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.493 HD22 ' H ' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -64.24 -40.25 95.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.185 179.549 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.48 -42.71 96.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.209 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.88 -43.8 98.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.944 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.577 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 56.7 t-105 -61.8 -44.01 97.71 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.293 0.568 . . . . 0.0 110.369 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -56.66 -42.6 79.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.103 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.24 -42.93 99.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.205 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.73 -41.25 90.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.99 0.424 . . . . 0.0 110.274 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.577 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 73.8 mt-30 -58.79 -47.29 85.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.184 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -63.56 -34.77 78.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.19 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 14.4 tp -62.43 -36.64 83.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.284 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.569 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 35.7 m170 65.89 110.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.074 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -134.74 154.19 79.3 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.74 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -40.61 153.92 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 122.562 2.174 . . . . 0.0 112.423 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.86 -50.2 5.59 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.682 2.255 . . . . 0.0 112.457 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.27 -47.82 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.575 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.833 ' NH2' ' HH ' ' A' ' 88' ' ' TYR . 64.8 ttt-85 -63.24 -39.47 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.083 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.89 -44.42 96.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.716 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.63 94.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.401 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.58 -44.99 69.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.3 tp -63.46 -46.87 84.24 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -62.09 -42.27 99.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.37 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.29 90.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.457 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -59.71 -52.56 64.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.495 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.51 -39.73 94.45 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.2 0.524 . . . . 0.0 110.378 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.3 -45.53 87.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.016 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.61 -42.68 96.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.822 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -52.28 -42.93 64.13 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -64.86 -41.31 95.79 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -61.63 -46.71 88.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.241 0.543 . . . . 0.0 110.586 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -63.28 -35.7 81.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.485 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.41 ' OE1' ' C ' ' A' ' 56' ' ' GLU . 10.4 tm-20 -58.14 -47.66 82.65 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.985 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.31 -42.38 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.305 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.03 -44.36 96.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.477 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.5 t90 -59.14 -41.63 88.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -60.16 -45.89 91.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -58.39 -43.28 88.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.977 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -61.91 -39.41 91.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.851 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.35 -41.96 90.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.71 -43.93 97.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.056 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -73.56 -22.44 60.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.18 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 87.36 13.24 66.03 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.8 mt -64.33 -41.64 96.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.69 0.281 . . . . 0.0 111.003 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -86.56 116.44 24.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.563 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -129.8 -31.73 1.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.414 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -63.05 -41.81 99.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.77 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.432 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 89.02 2.76 77.41 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -68.15 -34.25 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.859 0.362 . . . . 0.0 110.622 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.5 mttt -59.03 -59.05 6.09 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.71 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 13.5 pt-20 -58.76 -39.23 80.39 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.043 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -58.75 -41.43 86.48 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.406 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -64.95 -41.2 95.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.9 0.381 . . . . 0.0 110.07 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.27 -43.9 93.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.253 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 94.2 mt -64.24 -47.49 89.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.07 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -60.42 -44.21 95.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.194 179.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.441 ' O ' HG13 ' A' ' 84' ' ' ILE . 44.9 t30 -61.91 -41.04 97.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.511 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.425 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.01 -50.13 74.48 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.129 -179.427 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -64.93 -37.17 86.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.32 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.78 -45.96 95.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.442 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.01 -51.23 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.464 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.63 -40.36 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.788 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.56 79.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.966 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -61.4 -47.94 83.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.55 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.833 ' HH ' ' NH2' ' A' ' 41' ' ' ARG . 5.7 m-85 -61.95 -30.29 70.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.069 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.02 18.94 80.16 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 51.2 mt -88.91 2.36 53.91 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.323 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -60.42 -41.03 93.13 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.409 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.69 163.5 32.71 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.445 ' HG2' ' H ' ' A' ' 95' ' ' ASP . 65.5 tttm -148.51 158.66 44.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.921 0.391 . . . . 0.0 110.476 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -79.62 7.88 7.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.53 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.445 ' H ' ' HG2' ' A' ' 93' ' ' LYS . 67.1 t0 -61.43 -41.43 97.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.748 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 63.8 112.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.863 0.363 . . . . 0.0 110.807 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -137.78 144.47 41.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.278 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -162.17 123.71 2.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.591 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.32 137.12 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.835 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 99.9 m -108.67 110.91 22.46 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.579 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.1 p -168.34 165.27 12.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.643 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 66.0 t30 54.34 85.85 0.05 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.713 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.0 t -112.85 124.72 53.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.451 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.0 mp -128.86 148.81 50.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.621 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.9 m -68.33 -77.94 0.07 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.678 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 55.19 91.58 0.01 OUTLIER Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.649 ' HG1' ' H ' ' A' ' 108' ' ' GLN . 29.7 p -88.51 -62.99 1.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.931 0.396 . . . . 0.0 110.706 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.649 ' H ' ' HG1' ' A' ' 107' ' ' THR . 58.3 tt0 -151.68 155.74 38.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.545 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.42 ' OE1' ' OD2' ' A' ' 113' ' ' ASP . 69.2 mm-40 -124.07 133.98 53.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.65 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.423 ' C ' ' OD1' ' A' ' 110' ' ' ASP . 53.8 p30 -160.76 -174.28 4.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.628 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -45.44 -64.85 2.13 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.6 87.9 2.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.857 0.36 . . . . 0.0 110.777 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.42 ' OD2' ' OE1' ' A' ' 109' ' ' GLU . 33.0 p30 -94.64 -10.44 31.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.414 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -100.41 128.9 29.13 Favored Pre-proline 0 C--O 1.233 0.201 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.418 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -49.69 -35.47 38.49 Favored 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.41 2.073 . . . . 0.0 112.11 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -61.8 -45.13 95.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.871 0.367 . . . . 0.0 110.973 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.83 -38.52 89.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.542 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.538 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.7 mt-10 -61.67 -38.13 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.579 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.606 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 63.7 mttp -61.22 -45.74 93.31 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.54 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 41.5 mt -64.13 -46.15 85.43 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.913 0.387 . . . . 0.0 111.888 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 18.0 t-105 -57.8 -49.38 76.82 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.755 -179.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.538 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 7.7 m-70 -72.76 -31.99 65.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.46 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.606 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 1.0 OUTLIER -54.82 -51.52 65.59 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.73 -179.109 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.71 -46.59 52.9 Favored 'General case' 0 C--O 1.247 0.924 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.69 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 49.7 tttm -50.34 -41.59 51.6 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.781 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.5 m -95.08 -38.14 10.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.95 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -45.45 -27.34 0.7 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.961 0.41 . . . . 0.0 109.952 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.79 -92.26 0.09 OUTLIER Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.339 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -162.79 25.1 0.1 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.361 0.6 . . . . 0.0 109.525 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.414 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 8.7 m-85 -69.76 51.06 0.11 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.378 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 2.0 m -106.48 139.11 41.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.25 0.548 . . . . 0.0 111.747 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 89.12 -98.11 2.4 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.589 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 81.6 mm-40 -72.96 -43.83 61.83 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.96 -179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -61.27 -49.35 77.42 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.304 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 130' ' ' PHE . 1.5 mt -59.73 -40.4 87.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.306 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.56 -41.01 98.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.026 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.8 mttt -60.56 -42.75 97.24 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 121.387 0.613 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.403 HD22 ' N ' ' A' ' 138' ' ' LEU . 3.0 mm? -59.71 -42.96 94.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.29 94.26 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.834 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -51.69 -41.64 61.6 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.65 -40.89 76.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.508 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -60.38 -52.43 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.429 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.36 -41.09 92.98 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.247 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -53.88 -46.69 71.41 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.51 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.44 ' O ' ' CG2' ' A' ' 149' ' ' VAL . 9.3 m-70 -61.37 -40.58 94.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.441 ' O ' HG23 ' A' ' 149' ' ' VAL . 16.9 mmtt -59.37 -43.67 92.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.343 -179.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 143' ' ' LEU . 3.7 mp0 -70.7 -46.88 62.3 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.553 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.5 mttp -62.15 -47.05 86.26 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.12 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 146' ' ' LYS . 26.1 m -65.59 -37.13 79.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.02 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.577 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -63.81 -41.19 97.94 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.416 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -65.47 -45.65 82.87 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.332 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -62.86 -47.25 84.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 110.616 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . 0.404 ' O ' ' CG ' ' A' ' 157' ' ' GLU . 1.3 m120 -70.54 -46.61 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.226 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.577 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 75.6 t -62.27 -46.06 97.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.702 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.74 -51.69 66.14 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.447 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.523 ' HG ' ' N ' ' A' ' 157' ' ' GLU . 0.4 OUTLIER -66.1 -38.19 87.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.217 0.532 . . . . 0.0 110.515 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . 0.523 ' N ' ' HG ' ' A' ' 156' ' ' LEU . 93.2 mt-10 -69.28 -33.75 73.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.34 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 154' ' ' VAL . 64.0 m -65.97 -46.01 79.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.963 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.423 HD13 ' N ' ' A' ' 160' ' ' SER . 4.1 pp -77.55 -24.51 49.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.868 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.423 ' N ' HD13 ' A' ' 159' ' ' LEU . 81.9 p -67.6 -39.81 84.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.854 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -65.22 -44.71 87.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.188 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.633 ' C ' ' H ' ' A' ' 164' ' ' GLU . 1.6 m -96.18 176.52 6.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.636 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.51 ' H ' HG23 ' A' ' 162' ' ' THR . 70.9 mm-40 54.66 2.76 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.014 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.633 ' H ' ' C ' ' A' ' 162' ' ' THR . 65.1 tt0 -135.46 43.14 2.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.691 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.491 ' O ' ' CG ' ' A' ' 166' ' ' HIS . 16.6 tt -134.42 129.3 52.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.969 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.491 ' CG ' ' O ' ' A' ' 165' ' ' ILE . 73.9 m80 -159.36 24.45 0.19 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.745 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 167' ' ' GLU . 76.6 tt0 44.1 45.6 6.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.427 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -153.88 159.22 41.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.404 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 5.8 m -152.9 37.45 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.676 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.4 tt -154.54 130.81 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.64 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.49 158.27 1.99 Allowed Pre-proline 0 C--N 1.328 -0.342 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.388 179.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -55.64 141.23 84.1 Favored 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.55 2.167 . . . . 0.0 112.011 179.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.547 ' OG ' ' N ' ' A' ' 178' ' ' ILE . 22.9 t -154.91 130.78 10.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.695 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -101.66 -17.56 16.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.632 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.706 ' O ' ' N ' ' A' ' 177' ' ' ASP . 6.5 tt -112.49 113.91 26.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.966 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 10.6 m 46.22 -79.32 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.163 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.706 ' N ' ' O ' ' A' ' 175' ' ' LEU . 47.5 t0 -154.62 24.15 0.46 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.783 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.547 ' N ' ' OG ' ' A' ' 173' ' ' SER . 1.7 pp -139.47 166.42 21.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.856 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -65.05 134.64 54.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.222 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -62.58 130.92 43.73 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.515 ' OG ' ' N ' ' A' ' 182' ' ' VAL . 0.3 OUTLIER 175.47 -83.66 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.763 0.316 . . . . 0.0 110.58 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.64 ' C ' ' H ' ' A' ' 184' ' ' HIS . 97.0 t -140.59 -97.59 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.744 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 186' ' ' ARG . 9.7 tp 62.37 -37.69 0.14 Allowed 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.387 0.613 . . . . 0.0 110.848 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.64 ' H ' ' C ' ' A' ' 182' ' ' VAL . 13.8 p80 -56.93 -25.4 57.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.428 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.458 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 11.6 t -63.81 -46.02 87.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.514 -179.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.6 ' HE ' ' CE1' ' A' ' 187' ' ' HIS . 21.0 ptt180 -71.07 -41.57 70.53 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.326 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . 0.6 ' CE1' ' HE ' ' A' ' 186' ' ' ARG . 52.4 m-70 -65.02 -39.54 93.53 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.22 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 56.7 m -63.56 -44.16 94.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.996 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 185' ' ' SER . 96.8 mt-10 -62.95 -43.41 98.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.021 179.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.525 ' N ' HD12 ' A' ' 190' ' ' LEU . 9.7 mp -63.26 -44.21 95.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 62.5 mttp -67.87 -40.0 83.64 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -68.66 -50.56 50.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.839 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.432 ' HG2' ' H ' ' A' ' 194' ' ' LEU . 2.6 pttm -67.09 -42.93 83.79 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.202 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.542 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.74 -37.84 76.62 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.47 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.508 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 11.6 mmm180 -63.4 -39.87 95.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 58.1 m -62.02 -42.59 99.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.77 -44.09 96.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.786 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -62.78 -40.98 99.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.522 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.58 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 95.2 mt-30 -62.03 -37.91 86.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.293 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.82 -41.48 98.82 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.7 mt -63.82 -40.56 96.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.009 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -61.91 -38.17 87.39 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.413 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -63.45 -42.63 98.64 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.678 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.2 mt -60.56 -40.15 90.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.354 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -64.19 -43.08 96.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.062 179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.732 ' O ' ' N ' ' A' ' 210' ' ' GLN . 95.8 mtt-85 -63.14 -44.67 94.9 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.228 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.7 OUTLIER -64.39 -38.17 81.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.754 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 18.6 m -62.15 -35.7 79.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -103.89 -19.6 14.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.241 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.732 ' N ' ' O ' ' A' ' 206' ' ' ARG . 44.1 tt0 -115.84 -26.0 7.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -70.02 35.76 0.4 Allowed Glycine 0 CA--C 1.521 0.441 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.571 ' H ' ' C ' ' A' ' 210' ' ' GLN . 63.5 t80 -137.77 165.74 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.837 0.351 . . . . 0.0 110.652 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.551 ' N ' ' CG ' ' A' ' 212' ' ' TYR . 16.1 t -44.89 89.26 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.829 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 214' ' ' THR . . . . . 0.557 ' CG2' ' H ' ' A' ' 215' ' ' GLU . 27.7 m -138.35 175.28 9.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.459 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . 0.557 ' H ' ' CG2' ' A' ' 214' ' ' THR . 44.8 tt0 -145.93 166.16 26.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.499 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . 0.528 ' N ' ' HG2' ' A' ' 215' ' ' GLU . . . 65.15 143.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.684 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -167.15 -15.02 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.939 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.53 ' C ' ' H ' ' A' ' 220' ' ' GLU . 75.0 m-85 -135.03 -170.86 2.66 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.286 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 219' ' ' GLU . 81.1 tt0 58.36 0.14 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.645 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.53 ' H ' ' C ' ' A' ' 218' ' ' PHE . 3.7 mp0 -34.86 151.04 0.07 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.663 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -76.2 47.83 2.13 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.488 2.125 . . . . 0.0 112.223 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.475 ' HE ' ' HA ' ' A' ' 222' ' ' ARG . 0.0 OUTLIER -125.86 -82.57 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.798 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.547 HG11 ' H ' ' A' ' 224' ' ' ILE . 0.3 OUTLIER -59.61 -53.37 49.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.495 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.547 ' H ' HG11 ' A' ' 223' ' ' VAL . 0.7 OUTLIER -62.09 -34.96 66.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.356 0.598 . . . . 0.0 109.495 -179.467 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -65.91 -36.39 83.24 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.66 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.34 -43.06 92.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -62.42 -37.85 87.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.738 178.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -58.75 -40.61 84.37 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 231' ' ' GLN . 89.2 mt -62.96 -42.39 99.81 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.75 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.455 ' O ' ' CD1' ' A' ' 235' ' ' LEU . . . -38.96 -27.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 229' ' ' LEU . 17.4 tt0 -60.47 -42.44 96.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.634 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.8 m -125.64 61.66 1.23 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.655 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -127.73 -70.79 0.69 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.551 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -173.31 89.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.846 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . 0.472 ' N ' ' CD1' ' A' ' 235' ' ' LEU . 0.1 OUTLIER -136.01 -156.13 0.69 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.68 -179.679 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 168.49 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.499 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -59.69 -54.55 45.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.858 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.43 -41.77 93.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.172 0.511 . . . . 0.0 110.558 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -59.43 -34.27 72.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.201 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.11 -43.25 99.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.793 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -65.85 -50.6 63.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.535 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.72 89.33 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.132 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.47 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -65.02 -42.13 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.329 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -54.69 -52.93 60.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.983 0.42 . . . . 0.0 110.434 -179.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -65.61 -38.84 90.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.92 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -57.41 -54.14 50.24 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.364 0.602 . . . . 0.0 110.616 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.05 -37.13 85.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.534 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.552 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 43.3 tttp -55.32 -43.0 74.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 110.223 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -70.18 -39.3 75.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.334 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -60.65 -49.29 78.1 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.29 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.597 ' OE1' ' N ' ' A' ' 252' ' ' ALA . 0.1 OUTLIER -62.09 -39.4 92.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . 0.597 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.14 -37.32 85.41 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.536 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -62.74 -48.4 79.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.053 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -37.98 81.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.309 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -59.18 -47.13 86.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.511 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -63.21 -43.34 98.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.293 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . 0.404 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -58.2 -43.81 87.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.361 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . 0.421 ' OD1' ' C ' ' A' ' 258' ' ' ASN . 43.4 t-20 -61.14 -41.54 96.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.344 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -60.58 -48.56 81.24 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.1 0.476 . . . . 0.0 110.529 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -62.7 -34.56 77.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.397 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.525 HE21 ' CG2' ' A' ' 297' ' ' THR . 69.0 mm-40 -62.62 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.219 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.32 -47.72 83.0 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.087 0.47 . . . . 0.0 109.903 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.58 -37.19 86.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.936 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 61.7 tp -62.96 -42.36 99.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.198 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -61.82 -48.82 78.88 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.508 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.29 -42.77 96.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.012 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.91 83.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.153 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -62.85 -48.43 79.06 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.408 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -59.91 -46.12 90.36 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 110.473 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . 0.633 ' HZ1' ' NH2' ' A' ' 282' ' ' ARG . 88.4 tttt -61.36 -40.65 95.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.364 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 33.8 tp -59.73 -43.35 94.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.086 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -59.82 -44.14 94.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.12 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -68.15 -40.7 82.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.727 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -62.11 -37.04 83.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.728 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . 0.401 ' OE2' ' CG1' ' A' ' 283' ' ' VAL . 62.1 mm-40 -55.11 -19.56 7.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.871 0.367 . . . . 0.0 110.619 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 71.1 m -76.58 -11.46 59.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.505 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 7.9 p -63.06 -46.91 94.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.686 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.505 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 79.95 -13.3 25.86 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . 0.457 ' H ' HG13 ' A' ' 277' ' ' VAL . 81.3 m-20 -76.65 -11.6 59.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.782 0.325 . . . . 0.0 110.608 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 65.01 -140.35 41.83 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 60.72 -71.87 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.893 0.378 . . . . 0.0 110.598 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . 0.633 ' NH2' ' HZ1' ' A' ' 270' ' ' LYS . 55.2 ttt85 -60.94 -33.51 73.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.416 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . 0.401 ' CG1' ' OE2' ' A' ' 275' ' ' GLU . 42.7 t -59.78 -45.65 94.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.548 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 45.6 t -61.16 -47.42 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.979 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.05 -47.3 80.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.922 0.391 . . . . 0.0 111.037 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 44.4 m -59.93 -43.31 95.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.685 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -63.91 -40.63 96.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -58.79 -59.11 5.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.322 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -63.96 -40.93 97.54 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.956 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -44.65 -53.96 6.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.16 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.4 -35.43 79.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.438 179.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 20.8 tp -60.39 -50.22 74.47 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.322 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.36 -42.08 98.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.303 0.573 . . . . 0.0 109.936 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.515 ' O ' ' OG1' ' A' ' 297' ' ' THR . 16.2 tm-20 -62.0 -39.71 93.16 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.955 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.91 -40.91 99.86 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 7.9 tpp180 -61.73 -43.73 98.28 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.323 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.525 ' CG2' HE21 ' A' ' 261' ' ' GLN . 44.0 p -60.42 -43.85 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.263 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -62.78 -43.92 97.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.461 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -61.5 -42.02 98.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.283 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -44.59 96.46 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.412 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.26 -44.89 93.21 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -62.15 -41.98 98.81 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.115 0.483 . . . . 0.0 110.462 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 303' ' ' THR . . . . . 0.443 HG22 ' CE1' ' A' ' 307' ' ' HIS . 19.3 m -60.52 -44.5 95.97 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.424 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -61.26 -42.35 93.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.896 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -56.98 -48.33 78.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.075 0.465 . . . . 0.0 110.313 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.34 -41.55 98.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.694 179.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.443 ' CE1' HG22 ' A' ' 303' ' ' THR . 37.4 m80 -65.01 -36.47 84.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.239 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 6.0 mt -62.38 -44.84 95.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.835 0.35 . . . . 0.0 110.34 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -69.86 -42.87 72.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.472 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -64.19 -45.23 89.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.791 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 23.1 mt -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.741 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 95.4 p -61.94 -38.49 88.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.357 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.57 -42.9 95.36 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -66.1 -67.32 0.45 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.761 0.315 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . 0.585 ' O ' ' N ' ' A' ' 317' ' ' ARG . 4.8 mt -53.02 -94.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.549 ' C ' ' O ' ' A' ' 315' ' ' ILE . 6.6 t 25.08 -88.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.914 0.388 . . . . 0.0 110.575 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 315' ' ' ILE . 55.4 ttp180 -62.75 -47.52 83.17 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.559 ' N ' ' O ' ' A' ' 315' ' ' ILE . . . 28.59 61.32 0.13 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.38 0.61 . . . . 0.0 109.713 -177.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.509 HH21 ' C ' ' A' ' 323' ' ' LEU . 20.4 ptt180 -42.11 -101.94 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.234 -0.893 . . . . 0.0 112.239 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . 0.503 ' H ' ' HG3' ' A' ' 319' ' ' ARG . 15.3 p80 -141.75 18.07 2.16 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.301 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.569 ' C ' ' H ' ' A' ' 323' ' ' LEU . 27.7 t-20 -151.79 169.3 22.56 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.371 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 322' ' ' GLU . 79.2 tt0 -67.21 44.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.133 0.492 . . . . 0.0 109.784 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.569 ' H ' ' C ' ' A' ' 321' ' ' ASN . 8.9 mp . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 117.914 -1.041 . . . . 0.0 110.618 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.4 m -128.55 151.04 49.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.476 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -142.83 153.95 43.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.451 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -150.35 141.08 22.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.828 0.347 . . . . 0.0 110.391 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -133.18 146.84 51.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.149 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -82.61 162.93 21.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.474 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.663 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 1.7 tt0 -171.38 -41.51 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.185 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.663 ' HD2' ' H ' ' A' ' 7' ' ' GLN . 86.4 Cg_endo -87.97 -96.09 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 122.726 2.284 . . . . 0.0 112.467 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.8 tptm 53.87 69.91 1.98 Allowed Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.228 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -66.78 -24.42 47.08 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.681 2.254 . . . . 0.0 112.263 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.7 m 46.79 80.05 0.31 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.405 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.89 161.14 44.44 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.757 2.304 . . . . 0.0 112.115 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -64.29 148.7 49.66 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.236 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -144.99 167.66 22.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.6 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -104.04 160.71 14.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.495 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.7 p -68.6 163.52 23.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.543 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.48 82.17 0.04 OUTLIER Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -143.0 107.67 4.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.744 0.306 . . . . 0.0 110.284 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -69.63 -40.53 76.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.803 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -102.09 -178.82 3.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.726 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.449 HH12 HD23 ' A' ' 57' ' ' LEU . 90.0 mtm180 -93.75 6.01 49.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.364 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.519 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 10.0 tpt -144.88 130.07 18.58 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -60.95 -38.29 85.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.357 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.8 -47.97 81.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.569 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.5 -38.63 88.05 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.727 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.519 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.4 m-80 -64.18 -40.13 95.46 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.488 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -60.77 -49.58 76.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.74 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.469 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 3.6 mm? -61.92 -40.88 97.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.215 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 47.7 t-105 -61.84 -46.26 90.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.134 0.492 . . . . 0.0 110.423 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.423 ' HA ' HE21 ' A' ' 33' ' ' GLN . 95.4 mt-10 -57.59 -42.85 83.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.462 179.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -61.6 -42.78 99.36 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.99 -44.69 87.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.162 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.423 HE21 ' HA ' ' A' ' 30' ' ' GLU . 33.8 mt-30 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.172 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -60.2 -43.48 95.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.142 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.9 mt -65.01 -36.87 85.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.261 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.85 110.37 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.741 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.8 mt -127.33 155.81 75.87 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.806 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -40.94 154.42 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.535 2.157 . . . . 0.0 112.189 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.71 -47.14 26.88 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.548 2.165 . . . . 0.0 112.556 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.25 -45.08 97.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.412 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.2 mmt85 -63.86 -40.59 96.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.53 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 tp -62.54 -43.71 98.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.529 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.98 89.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.412 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -67.9 -48.56 65.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.452 HD11 ' N ' ' A' ' 45' ' ' LEU . 8.1 mp -62.98 -45.46 92.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.646 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -63.8 -44.11 94.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.851 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.618 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.18 -48.73 80.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.071 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -57.43 -46.89 83.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.926 0.393 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.13 -40.84 86.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.917 0.389 . . . . 0.0 110.046 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.22 -39.91 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.088 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.618 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.9 mm -62.3 -43.78 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.054 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -58.62 -45.32 89.45 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.542 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.34 -47.01 87.03 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.128 0.489 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -64.16 -39.56 94.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.684 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.426 ' C ' ' OD1' ' A' ' 55' ' ' ASP . 60.4 t0 -60.56 -43.46 97.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.597 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -61.72 -43.88 97.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.033 0.444 . . . . 0.0 110.135 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.449 HD23 HH12 ' A' ' 21' ' ' ARG . 52.1 tp -60.5 -41.74 94.91 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.199 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.3 99.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.605 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.8 -42.41 93.36 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.342 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -61.08 -45.45 94.67 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -57.84 -44.02 86.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.179 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.9 mt -61.92 -42.11 98.72 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.139 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -56.26 -47.05 79.3 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.27 -0.572 . . . . 0.0 109.639 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.3 mt -64.55 -37.59 88.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.946 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -61.83 -20.63 63.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.834 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.8 32.82 5.24 Favored Glycine 0 C--N 1.335 0.513 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 179.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 94.3 mt -123.35 -164.42 1.21 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.257 0.551 . . . . 0.0 110.333 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 61.79 95.32 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.44 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -127.6 -32.54 2.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.835 0.35 . . . . 0.0 110.475 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -65.33 -39.21 92.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.653 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 85.22 -0.17 88.72 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -64.31 -35.13 79.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.701 0.286 . . . . 0.0 110.275 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -58.04 -59.8 4.72 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.129 0.49 . . . . 0.0 110.162 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -55.57 -41.48 73.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.283 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.2 -38.67 87.37 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.352 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -62.49 -42.94 99.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.462 ' N ' HD12 ' A' ' 77' ' ' LEU . 10.2 mp -62.47 -43.08 99.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.49 -47.52 91.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.215 0.531 . . . . 0.0 110.134 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.3 mtt85 -61.21 -41.22 96.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.218 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.436 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.58 -49.26 78.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.082 0.468 . . . . 0.0 110.346 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.07 -38.54 88.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.14 -47.05 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.636 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.8 -49.35 84.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.436 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.035 0.445 . . . . 0.0 110.724 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.84 93.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.849 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -61.63 -48.38 81.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.435 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -76.25 -16.31 59.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.12 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 58.51 38.42 91.03 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.5 mt -102.09 14.98 30.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 110.547 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -57.05 -48.02 79.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.594 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.55 154.17 22.81 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 14.8 mmmt -140.56 -85.56 0.2 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.763 0.316 . . . . 0.0 110.715 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -161.6 137.2 7.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.584 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.86 156.52 41.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.875 0.369 . . . . 0.0 110.7 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -155.55 106.59 2.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.346 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 51.3 ptt85 -140.69 142.25 34.9 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.802 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.517 ' CD ' ' N ' ' A' ' 98' ' ' GLN . 2.1 pm0 -137.96 73.08 1.43 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.397 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 55.4 t -122.37 131.27 73.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.33 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.1 p -110.7 7.12 22.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.558 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 90.9 p -61.26 -35.69 77.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.345 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.583 ' O ' ' N ' ' A' ' 104' ' ' LEU . 50.6 p-10 -85.13 -26.56 26.8 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.521 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.521 ' N ' ' OD1' ' A' ' 102' ' ' ASN . 10.5 m 47.66 -84.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.819 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.583 ' N ' ' O ' ' A' ' 102' ' ' ASN . 0.6 OUTLIER 45.07 56.18 5.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.147 0.499 . . . . 0.0 110.266 -179.844 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.1 p -149.37 164.72 34.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.555 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.54 78.18 1.29 Allowed Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 42.6 p -63.07 -34.12 76.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.635 0.255 . . . . 0.0 110.524 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -60.21 125.17 22.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.164 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -126.37 135.75 51.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.763 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 39.4 p-10 -149.99 123.02 8.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.395 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -147.97 -111.45 0.63 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.51 ' O ' ' CG ' ' A' ' 118' ' ' GLU . 5.5 mp -111.03 138.74 47.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.84 0.353 . . . . 0.0 110.748 -179.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.55 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 97.0 m-20 -88.31 -26.78 22.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.623 179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -61.63 109.07 1.87 Allowed Pre-proline 0 C--N 1.331 -0.216 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.438 ' HD3' ' O ' ' A' ' 113' ' ' ASP . 52.5 Cg_exo -52.6 -37.8 74.83 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 122.514 2.143 . . . . 0.0 112.526 -179.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 83.1 mtt85 -63.15 -45.32 92.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.11 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.19 -32.83 56.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.733 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.627 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 39.6 mt-10 -58.44 -42.2 86.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.8 mttt -60.16 -42.55 95.16 Favored 'General case' 0 C--N 1.318 -0.761 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.435 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.4 mt -64.4 -47.44 79.18 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.068 0.461 . . . . 0.0 111.773 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.464 ' CE2' HD12 ' A' ' 135' ' ' LEU . 10.2 t-105 -64.24 -44.78 90.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.592 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.627 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -69.24 -34.98 75.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.745 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.554 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.4 mptt -60.25 -51.2 70.58 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.232 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -74.57 -46.31 39.63 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.722 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.41 ' HD2' ' NE1' ' A' ' 121' ' ' TRP . 62.9 tttp -53.21 -44.26 67.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.311 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -102.68 -60.08 1.6 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.935 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -61.65 -6.21 2.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.787 -178.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -135.65 4.41 4.0 Favored Glycine 0 C--N 1.329 0.174 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.486 ' CG ' ' O ' ' A' ' 128' ' ' GLY . 19.0 ptpt 43.44 21.09 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.17 0.509 . . . . 0.0 109.84 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.495 ' N ' ' O ' ' A' ' 128' ' ' GLY . 32.8 m-85 -78.78 50.75 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.586 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.7 p -94.5 130.11 41.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 112.105 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.13 -98.72 1.33 Allowed Glycine 0 CA--C 1.534 1.267 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.869 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.451 ' HG2' ' H ' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -80.3 -43.64 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.049 -179.226 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.451 ' H ' ' HG2' ' A' ' 133' ' ' GLU . 67.8 mm-40 -64.96 -42.96 94.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.464 HD12 ' CE2' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.79 -43.51 98.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.942 179.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -62.3 -39.29 92.51 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.952 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -60.41 -43.29 96.87 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.37 0.605 . . . . 0.0 109.852 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.415 ' N ' HD21 ' A' ' 138' ' ' LEU . 2.8 mm? -59.68 -43.84 93.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -36.92 85.65 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.55 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 88.7 mtt-85 -53.49 -41.51 66.33 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.542 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 0.4 OUTLIER -71.26 -43.36 67.36 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.853 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -58.47 -54.86 42.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.407 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.49 -38.91 89.04 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.309 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 34.9 m170 -54.75 -42.79 72.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.613 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -66.31 -39.8 89.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.637 178.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -61.27 -47.25 86.87 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.379 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -71.49 -43.01 67.33 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.541 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.67 -44.13 97.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.797 0.332 . . . . 0.0 110.456 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.9 t -64.4 -44.43 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.603 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.629 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.1 m170 -60.63 -39.58 88.75 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.43 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.81 -43.18 99.48 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.678 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.557 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 24.5 m-85 -65.45 -49.63 68.43 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.842 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -68.62 -42.26 78.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.023 0.44 . . . . 0.0 110.997 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.629 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 73.2 t -63.03 -45.16 99.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.947 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.5 mt -63.58 -45.7 89.22 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.761 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.46 ' N ' HD21 ' A' ' 156' ' ' LEU . 2.2 mm? -64.0 -42.19 97.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.564 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -69.68 -31.09 68.94 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.167 178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' THR . . . . . 0.495 ' HA ' HH21 ' A' ' 161' ' ' ARG . 64.0 m -64.34 -51.55 62.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.174 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.4 HD12 ' N ' ' A' ' 160' ' ' SER . 1.8 pp -72.01 -34.4 68.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.807 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.4 ' N ' HD12 ' A' ' 159' ' ' LEU . 74.5 m -60.51 -43.18 97.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.788 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.495 HH21 ' HA ' ' A' ' 158' ' ' THR . 88.6 mtm180 -63.39 -47.54 81.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.314 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.738 ' C ' ' H ' ' A' ' 164' ' ' GLU . 13.0 p -91.34 175.01 7.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.557 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 61.43 -18.78 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.045 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.738 ' H ' ' C ' ' A' ' 162' ' ' THR . 32.5 tt0 -109.3 42.22 1.49 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.4 tt -135.07 141.14 43.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.085 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.425 ' O ' ' CG ' ' A' ' 167' ' ' GLU . 0.3 OUTLIER -172.13 25.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.791 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 166' ' ' HIS . 18.4 pt-20 43.76 25.45 0.09 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.975 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -171.36 121.9 0.53 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.591 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 43.4 t -130.19 94.01 2.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.489 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.8 tt -171.0 125.23 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.56 160.92 5.0 Favored Pre-proline 0 N--CA 1.453 -0.312 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.13 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -50.68 128.28 23.51 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 122.312 2.008 . . . . 0.0 111.788 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 51.0 p -154.78 161.23 41.58 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.495 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -160.12 -28.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.426 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 36.0 tp -84.89 102.13 12.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.934 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 6.4 m 43.99 26.05 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.469 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 60.27 27.52 17.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 2.5 pp -141.89 165.47 17.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.531 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -72.3 139.13 47.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.411 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -103.89 131.25 10.56 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.496 ' O ' ' NE2' ' A' ' 184' ' ' HIS . 1.9 m 174.9 -74.2 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.804 0.335 . . . . 0.0 110.504 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.448 ' CG1' ' O ' ' A' ' 182' ' ' VAL . 64.8 t -128.14 7.56 3.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.069 0.462 . . . . 0.0 110.573 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.84 -40.87 94.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.464 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.496 ' NE2' ' O ' ' A' ' 181' ' ' SER . 6.9 p80 -53.7 -43.74 69.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.578 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 41.7 t -60.26 -44.06 95.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.196 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.77 -45.57 93.81 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.098 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -61.25 -39.91 92.09 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.291 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.9 m -61.11 -44.41 97.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.246 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -58.81 -40.34 83.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.971 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.487 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 8.5 mp -63.18 -41.06 99.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.459 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.546 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 67.5 mttm -67.35 -34.06 76.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.59 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.479 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 97.2 mt-10 -67.6 -50.28 58.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.557 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 10.6 ptmt -72.28 -44.7 62.39 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.358 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.548 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.95 -41.51 86.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.102 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.546 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -65.92 -36.88 84.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 192' ' ' GLU . 55.6 m -61.56 -43.38 98.97 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.42 -44.12 97.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.849 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.439 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.3 m-20 -62.0 -42.05 98.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.582 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.477 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 14.9 mm100 -62.24 -38.59 89.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.381 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.4 -42.3 99.74 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 18.3 mt -63.25 -41.97 99.12 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.235 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.498 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.1 OUTLIER -62.8 -36.64 83.8 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -63.92 -42.27 97.43 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.616 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.48 -39.43 90.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.409 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -62.04 -45.12 94.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.222 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.554 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.7 mtt180 -65.3 -36.58 84.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.16 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.51 -45.88 96.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.252 0.548 . . . . 0.0 110.279 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 80.6 p -72.37 -26.67 61.98 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.535 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -95.34 -14.58 23.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.513 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -146.11 -25.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.718 0.294 . . . . 0.0 111.109 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -73.06 33.7 0.76 Allowed Glycine 0 CA--C 1.518 0.271 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.553 ' H ' ' C ' ' A' ' 210' ' ' GLN . 68.9 t80 -60.76 -47.47 86.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.786 0.327 . . . . 0.0 110.37 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 174.79 85.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.407 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 33.5 p -134.39 165.15 25.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.501 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -140.42 140.65 35.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.715 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.63 143.23 44.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.507 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.442 ' O ' ' C ' ' A' ' 218' ' ' PHE . 11.8 mt-10 -158.64 34.04 0.23 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.247 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.569 ' O ' ' C ' ' A' ' 219' ' ' GLU . 33.7 m-85 -33.81 97.27 0.01 OUTLIER 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.426 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.569 ' C ' ' O ' ' A' ' 218' ' ' PHE . 2.2 tm-20 36.19 -139.38 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -178.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 59.3 mt-10 -87.26 148.97 46.05 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.163 176.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.75 81.93 1.27 Allowed 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.564 2.176 . . . . 0.0 112.146 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 175.98 -36.6 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.752 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.583 ' CG1' ' H ' ' A' ' 224' ' ' ILE . 1.5 p -68.92 -76.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.168 0.508 . . . . 0.0 110.698 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.583 ' H ' ' CG1' ' A' ' 223' ' ' VAL . 1.2 mp -50.61 -26.65 4.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.132 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -67.01 -50.03 63.43 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.371 0.605 . . . . 0.0 109.943 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 12.3 tp -56.79 -37.41 71.1 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 44.8 m0 -63.96 -42.56 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.193 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . 0.507 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 97.1 m-20 -66.76 -18.44 65.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.466 ' O ' ' N ' ' A' ' 232' ' ' SER . 1.7 mt -77.81 -44.61 26.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.061 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 232' ' ' SER . . . -36.68 -62.16 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.198 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.507 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 7.4 pt20 -38.39 -31.94 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.673 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.466 ' N ' ' O ' ' A' ' 229' ' ' LEU . 66.5 m -118.4 52.62 1.01 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.374 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -141.41 46.26 1.71 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . 0.542 ' N ' ' ND2' ' A' ' 234' ' ' ASN . 0.8 OUTLIER 61.95 72.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.379 179.574 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 20.0 mt -125.08 148.04 48.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.696 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 66.6 p -66.36 -165.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.463 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . 0.507 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 31.3 p-10 -95.84 -48.18 5.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . 0.507 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 97.9 mttt -62.58 -43.35 99.03 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.03 0.443 . . . . 0.0 110.675 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -64.68 -33.63 76.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.013 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . 0.402 ' O ' HD12 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -62.56 -43.49 98.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.306 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -65.12 -49.66 69.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.405 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.14 -39.91 91.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.089 0.471 . . . . 0.0 110.002 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.486 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.14 -44.11 93.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.103 179.033 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -47.55 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.036 0.445 . . . . 0.0 110.193 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -65.62 -47.43 75.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.751 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -56.28 -50.94 69.93 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.495 0.664 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.6 mm? -63.43 -37.82 88.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.776 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.452 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 89.0 tttt -53.76 -45.38 70.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.391 0.615 . . . . 0.0 109.995 -179.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -67.48 -40.63 85.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.697 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -61.01 -48.98 79.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.638 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.452 ' CG ' ' O ' ' A' ' 248' ' ' LYS . 13.5 pt-20 -59.31 -38.16 79.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . 0.409 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -65.48 -38.17 88.98 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.521 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -62.9 -49.57 74.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.554 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 9.7 tt -64.97 -31.84 55.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.17 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -62.22 -46.36 89.22 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.214 0.53 . . . . 0.0 110.054 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.22 -42.48 99.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.973 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -56.42 -43.83 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.339 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -61.93 -40.79 96.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.118 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -57.03 -46.33 82.45 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.274 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -63.7 -37.4 87.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.513 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 30.8 mm-40 -57.72 -48.72 78.79 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.35 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -62.28 -43.1 99.61 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.189 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -65.49 -35.42 80.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.973 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 39.4 tp -63.7 -43.85 95.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.42 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -64.21 -44.72 91.06 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.542 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.44 -42.93 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.089 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.61 87.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.361 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -62.02 -48.52 79.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -61.61 -46.69 88.78 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 110.66 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.78 -37.66 85.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.349 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 49.3 tp -61.82 -43.99 97.74 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -61.59 -43.0 99.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.41 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -72.13 -37.69 69.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . 0.453 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -63.1 -37.12 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.862 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.7 -30.77 71.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.715 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 90.7 p -86.71 2.43 48.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.712 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.456 ' CG1' ' N ' ' A' ' 278' ' ' GLY . 9.5 p -60.74 -41.97 90.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.455 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.456 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 123.73 -57.45 0.65 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -96.74 111.35 23.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.803 0.335 . . . . 0.0 110.584 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -74.08 106.93 2.13 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -136.6 -21.08 1.32 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.311 . . . . 0.0 110.651 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -124.81 -4.22 7.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.705 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 284' ' ' SER . 11.3 p -63.24 -46.04 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 284' ' ' SER . . . . . 0.412 ' N ' ' CG1' ' A' ' 283' ' ' VAL . 10.6 t -63.78 -49.34 73.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.075 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.53 -43.03 98.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.86 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 48.5 t -60.27 -44.56 95.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.52 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . 0.421 ' O ' ' HB3' ' A' ' 290' ' ' HIS . 60.0 ttt85 -63.24 -41.05 99.04 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.228 0.537 . . . . 0.0 110.632 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -56.81 -57.51 12.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.252 0.548 . . . . 0.0 109.959 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -64.54 -31.34 72.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.153 179.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . 0.421 ' HB3' ' O ' ' A' ' 287' ' ' ARG . 52.0 t-80 -53.13 -49.93 65.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.29 -37.62 71.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.618 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 26.3 tp -61.46 -50.76 71.46 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.594 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.3 mp -63.82 -41.65 97.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.135 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.16 -40.46 97.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.323 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.69 -47.21 91.8 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -63.66 -37.45 87.39 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.51 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.513 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 8.3 m -60.23 -50.27 74.31 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.488 -179.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.41 -40.07 96.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.412 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -58.93 -45.47 90.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.358 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.46 -44.51 96.98 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.297 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.36 -43.56 84.74 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . 0.475 ' CE1' ' NZ ' ' A' ' 306' ' ' LYS . 49.3 t80 -62.25 -42.43 99.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.162 0.506 . . . . 0.0 110.489 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 17.2 m -60.48 -44.29 96.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.643 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.31 -43.25 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.046 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.79 -49.44 76.61 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.045 0.45 . . . . 0.0 110.937 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . 0.475 ' NZ ' ' CE1' ' A' ' 302' ' ' TYR . 34.7 mmtm -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.805 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -66.31 -31.25 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.921 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.12 -49.92 75.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.238 -179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -69.71 -40.1 76.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.634 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -60.05 -51.17 70.76 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.885 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 30.2 mt -63.25 -39.82 95.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.442 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.7 t -58.89 -43.41 90.94 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.685 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.9 -49.89 56.1 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.726 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.93 -43.6 95.4 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.7 mm -64.34 -43.14 97.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.809 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 99.5 p -56.07 -34.55 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.864 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 14.3 tpp180 -69.67 -75.53 0.11 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.493 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 47.97 84.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.1 -178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -78.14 -164.01 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.15 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 45.4 m170 -42.42 -67.76 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.244 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.467 ' O ' ' OD1' ' A' ' 321' ' ' ASN . 36.6 p-10 -136.97 118.31 14.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.782 0.325 . . . . 0.0 110.514 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 321' ' ' ASN . 84.9 tt0 56.83 152.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.493 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.426 ' N ' ' CD2' ' A' ' 323' ' ' LEU . 4.2 mm? . . . . . 0 C--O 1.221 -0.42 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.235 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.5 p -140.31 132.4 27.93 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.474 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.614 HH12 ' CE ' ' A' ' 5' ' ' LYS . 70.6 ttt-85 -85.66 -34.6 21.29 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.508 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.471 ' HG2' ' N ' ' A' ' 5' ' ' LYS . 69.8 tt0 78.02 -121.21 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.851 179.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.614 ' CE ' HH12 ' A' ' 3' ' ' ARG . 7.6 ttpt 49.36 30.69 3.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.644 -179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.471 ' O ' ' O ' ' A' ' 5' ' ' LYS . 17.8 m120 39.95 -165.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -165.41 145.64 5.73 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.154 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.13 157.7 58.83 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.404 2.069 . . . . 0.0 112.321 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.577 ' H ' ' HD2' ' A' ' 10' ' ' PRO . 4.7 mtpm? -137.54 -60.89 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.335 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.134 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.577 ' HD2' ' H ' ' A' ' 9' ' ' LYS . 83.4 Cg_exo -36.35 143.64 0.11 Allowed 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.571 2.18 . . . . 0.0 112.424 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.15 172.58 7.06 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.813 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -62.51 145.85 95.48 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.976 2.45 . . . . 0.0 112.171 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -131.05 144.6 51.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.52 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 80.8 mtp85 -135.41 144.72 46.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.314 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 58.29 111.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.441 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.9 m -121.92 122.07 38.54 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.621 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -94.43 157.58 22.55 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -173.03 110.13 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.48 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 56.3 mp0 -93.88 -24.36 17.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.901 0.381 . . . . 0.0 110.556 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -133.91 162.06 33.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.728 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp85 -77.4 -11.48 59.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.69 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -134.83 145.7 48.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 110.988 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.35 -33.65 76.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.722 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -59.02 -47.23 85.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 109.887 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.421 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 9.4 mp -64.13 -37.94 89.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.292 178.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -63.79 -41.24 97.96 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.602 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -65.15 -45.12 86.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.107 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.47 HD23 ' N ' ' A' ' 28' ' ' LEU . 1.6 mm? -63.36 -41.78 98.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.479 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -63.29 -47.81 80.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.09 0.472 . . . . 0.0 110.358 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.5 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 80.8 tt0 -60.83 -39.19 88.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.199 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -45.0 96.38 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.06 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -41.36 96.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -59.45 -40.05 85.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.027 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.5 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -64.57 -39.01 92.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.339 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.4 mt -63.54 -36.73 84.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.383 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 65.95 106.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.604 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -129.4 154.47 80.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.63 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -43.95 153.77 0.28 Allowed 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.369 2.046 . . . . 0.0 112.528 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -58.73 -41.05 67.31 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.681 2.254 . . . . 0.0 112.364 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.01 -49.12 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.852 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.74 -41.57 92.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.622 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -65.25 -42.36 93.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -51.71 64.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.176 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.01 -38.48 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.504 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.9 tp -62.16 -50.77 70.51 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.043 0.449 . . . . 0.0 110.621 -179.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -61.1 -40.82 95.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.21 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.601 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.29 -49.77 75.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.073 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -58.82 -46.03 88.58 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.996 0.427 . . . . 0.0 110.584 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.0 mt -59.93 -41.07 90.95 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -58.99 -38.79 80.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.145 178.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.601 HG12 ' O ' ' A' ' 47' ' ' ALA . 45.5 mm -62.16 -44.42 99.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -58.81 -43.96 90.69 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.606 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.97 -48.37 81.79 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.971 0.415 . . . . 0.0 110.453 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -60.25 -44.54 95.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.752 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.94 -40.66 94.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.505 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.07 -45.74 91.9 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 110.103 179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.31 -42.97 99.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.966 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.83 96.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.557 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.2 t90 -58.52 -44.08 89.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.095 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.77 -46.5 90.21 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 120.624 -0.43 . . . . 0.0 109.914 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.11 -41.05 97.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.085 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.677 ' CD1' ' HZ3' ' A' ' 73' ' ' LYS . 79.7 mt -61.62 -41.2 97.14 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.45 -38.74 88.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 tt -60.88 -43.69 98.11 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.87 -35.03 79.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.43 179.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.48 36.96 4.16 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 111.263 -0.735 . . . . 0.0 111.263 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 88.7 mt -96.55 -69.19 0.77 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.75 0.309 . . . . 0.0 110.649 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.469 ' O ' ' OD1' ' A' ' 68' ' ' ASP . 16.2 p30 -63.26 142.52 58.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.472 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -160.36 -26.42 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.528 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -68.16 -27.44 66.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.461 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.9 8.91 83.54 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.02 -40.69 91.29 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.573 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.677 ' HZ3' ' CD1' ' A' ' 62' ' ' LEU . 39.7 mtpt -62.49 -47.81 82.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.021 0.439 . . . . 0.0 110.362 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.99 -42.55 94.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.467 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.84 -40.28 94.77 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -62.25 -41.97 98.92 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.608 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.52 -43.8 96.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.444 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.405 HD11 HG21 ' A' ' 78' ' ' ILE . 96.7 mt -64.77 -45.66 94.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.302 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.423 ' O ' ' CG2' ' A' ' 83' ' ' VAL . 92.1 mtt-85 -63.09 -41.29 99.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.992 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -64.03 -39.59 94.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.337 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.407 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -60.16 -51.39 69.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.901 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.436 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 60.7 t-20 -66.23 -38.91 89.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.705 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.423 ' CG2' ' O ' ' A' ' 79' ' ' ARG . 60.8 t -62.29 -47.46 92.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.691 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.423 HD11 HG23 ' A' ' 84' ' ' ILE . 96.6 mt -62.9 -47.11 94.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.63 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.23 -41.11 90.51 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.638 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.59 -47.62 84.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.989 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -62.64 -44.8 95.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 110.404 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -63.65 -32.74 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.065 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 79.46 22.61 64.43 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.8 mt -98.11 14.92 25.88 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.886 0.374 . . . . 0.0 110.338 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -60.89 -43.78 98.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.693 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 150.89 -116.72 0.79 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.8 tttt 60.93 124.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.006 0.432 . . . . 0.0 110.301 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -104.62 133.14 49.97 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.935 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -93.21 -35.48 13.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.743 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 56.99 78.83 0.21 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.888 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -128.6 -72.85 0.6 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.364 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 63.0 tp60 57.95 103.04 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.788 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.1 p -126.44 131.89 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.536 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -87.27 -25.84 23.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.747 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.426 ' HG ' ' N ' ' A' ' 102' ' ' ASN . 34.2 t -69.2 152.73 44.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.613 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.426 ' N ' ' HG ' ' A' ' 101' ' ' SER . 47.0 p-10 -126.39 168.9 13.54 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.606 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 69.4 p 45.29 50.4 9.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.439 ' N ' ' CD2' ' A' ' 104' ' ' LEU . 4.4 mm? -62.22 -43.19 99.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.506 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.1 m -160.87 -46.45 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.563 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.48 95.57 1.71 Allowed Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.6 m -61.1 -44.45 97.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.756 0.312 . . . . 0.0 110.814 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 55.39 78.46 0.19 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.743 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -72.09 -38.96 69.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.86 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -85.35 167.16 15.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.811 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -137.3 -78.36 0.08 OUTLIER Glycine 0 CA--C 1.523 0.579 0 N-CA-C 111.096 -0.801 . . . . 0.0 111.096 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.4 mt -112.36 141.74 45.72 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -119.73 -84.64 0.66 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.699 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -58.13 144.13 77.04 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.656 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.1 -20.91 43.44 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.419 2.079 . . . . 0.0 112.16 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -65.23 -38.97 92.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.934 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.1 mp -85.78 -27.19 25.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.863 0.364 . . . . 0.0 110.778 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 93.5 mt-10 -59.5 -44.02 93.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 20.3 pttp -60.6 -41.5 94.89 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.257 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.429 ' N ' ' CG ' ' A' ' 119' ' ' LYS . 11.8 mt -62.12 -44.92 95.59 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.638 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.424 ' CE2' HD12 ' A' ' 135' ' ' LEU . 15.6 t-105 -61.76 -47.16 86.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.318 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.508 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.9 m-70 -67.68 -38.9 84.34 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.125 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.545 ' O ' ' CB ' ' A' ' 127' ' ' SER . 12.9 tptt -58.58 -51.45 69.83 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.911 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.04 -45.75 63.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.649 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -48.33 -44.45 34.19 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.196 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.453 ' C ' ' H ' ' A' ' 128' ' ' GLY . 23.3 m -107.08 -60.54 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.818 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.71 -8.87 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.898 -178.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 0.587 ' C ' ' H ' ' A' ' 130' ' ' PHE . . . -137.58 4.38 3.34 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 48.92 11.03 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.135 0.493 . . . . 0.0 109.786 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.587 ' H ' ' C ' ' A' ' 128' ' ' GLY . 24.3 m-85 -71.58 50.45 0.18 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.421 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.7 p -97.94 112.9 24.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 112.145 -179.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.404 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.44 -98.37 0.62 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.711 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.465 ' CG ' ' N ' ' A' ' 134' ' ' GLU . 10.0 pt-20 -77.18 -44.0 31.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.839 0.352 . . . . 0.0 111.31 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.465 ' N ' ' CG ' ' A' ' 133' ' ' GLU . 79.5 mm-40 -66.08 -41.92 90.05 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.424 HD12 ' CE2' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.07 -43.18 99.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.862 179.373 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.513 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.3 OUTLIER -62.31 -37.99 87.68 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.936 179.769 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.434 ' N ' ' OD1' ' A' ' 136' ' ' ASP . 36.2 mmtm -60.15 -44.15 95.2 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.981 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.454 HD22 ' O ' ' A' ' 134' ' ' GLU . 3.6 mm? -60.64 -43.03 98.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.34 -34.84 79.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 177.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -58.5 -39.09 79.09 Favored 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.988 178.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -70.62 -44.29 67.51 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.995 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -58.91 -56.29 24.18 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.74 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.768 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 97.4 mt -60.82 -39.84 90.53 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.579 -0.448 . . . . 0.0 109.815 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -55.19 -41.28 71.75 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.479 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -63.87 -45.88 87.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.384 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.768 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 46.7 pttt -57.55 -45.75 84.74 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.549 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.533 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 77.8 mm-40 -68.91 -50.18 51.7 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -63.09 -44.32 96.04 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.975 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.404 HG12 ' O ' ' A' ' 146' ' ' LYS . 1.2 p -64.88 -38.09 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.716 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.572 ' O ' ' CG2' ' A' ' 154' ' ' VAL . 2.3 m170 -65.92 -41.26 91.63 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.228 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.38 -43.16 95.37 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.939 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.514 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 3.8 m-85 -61.88 -50.84 70.62 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.853 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -69.77 -44.05 70.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.307 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.572 ' CG2' ' O ' ' A' ' 150' ' ' HIS . 74.2 t -63.4 -46.9 94.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.922 -179.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 74.0 mt -63.91 -48.48 76.44 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.401 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.506 ' HG ' ' N ' ' A' ' 157' ' ' GLU . 0.3 OUTLIER -65.87 -39.72 90.97 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.014 -179.88 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . 0.53 ' O ' ' OG ' ' A' ' 160' ' ' SER . 93.9 mt-10 -68.18 -30.69 69.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.321 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' THR . . . . . 0.409 HG23 HH21 ' A' ' 161' ' ' ARG . 61.2 m -66.16 -47.51 73.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.338 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.4 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 3.4 pp -77.56 -21.21 52.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.567 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 95.2 p -61.88 -24.58 67.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.728 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.409 HH21 HG23 ' A' ' 158' ' ' THR . 87.5 mtm180 -59.97 -45.58 92.23 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.038 -179.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.44 24.46 3.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.018 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -114.25 -26.63 7.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.396 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -85.72 33.3 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.954 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.428 ' O ' ' CG2' ' A' ' 165' ' ' ILE . 16.6 tt -134.24 128.46 52.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.03 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 51.6 m80 -157.68 25.67 0.28 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.343 0.592 . . . . 0.0 109.553 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.537 ' O ' ' CG ' ' A' ' 168' ' ' ASN . 77.8 tt0 55.95 46.92 21.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.396 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.537 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 2.8 p-10 47.35 55.5 8.15 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.394 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 51.5 t -124.99 131.57 72.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.96 0.409 . . . . 0.0 110.584 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.0 tt -142.29 142.35 27.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.627 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' SER . . . . . 0.42 ' O ' ' N ' ' A' ' 173' ' ' SER . 0.3 OUTLIER -132.4 155.49 81.2 Favored Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.214 179.775 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -63.42 64.5 0.18 Allowed 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.586 2.191 . . . . 0.0 111.911 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 171' ' ' SER . 3.9 m -158.45 121.97 3.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.925 0.393 . . . . 0.0 110.735 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -66.65 -40.53 88.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.428 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.583 ' O ' ' N ' ' A' ' 177' ' ' ASP . 93.0 mt -120.95 88.13 2.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.274 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 48.4 -84.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.276 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 175' ' ' LEU . 55.5 p30 -171.36 30.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.696 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.443 HD11 ' H ' ' A' ' 180' ' ' GLY . 1.6 pp -126.69 163.21 29.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.908 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -87.63 50.4 1.99 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.409 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.443 ' H ' HD11 ' A' ' 178' ' ' ILE . . . 79.23 18.61 73.91 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 7.3 t -67.72 -22.22 65.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.788 0.327 . . . . 0.0 110.927 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 184' ' ' HIS . 9.0 t -133.67 165.55 31.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.645 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.714 ' CD1' HH21 ' A' ' 186' ' ' ARG . 0.9 OUTLIER 62.23 4.76 1.32 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.421 -179.87 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.718 ' HD1' ' N ' ' A' ' 185' ' ' SER . 5.7 p80 -65.64 -36.3 83.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.392 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.718 ' N ' ' HD1' ' A' ' 184' ' ' HIS . 5.9 t -64.15 -46.26 84.83 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.462 -179.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.714 HH21 ' CD1' ' A' ' 183' ' ' LEU . 45.5 mtm-85 -66.59 -45.3 79.68 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.285 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -67.08 -43.46 82.51 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.338 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.4 m -63.69 -45.01 91.98 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.999 0.428 . . . . 0.0 110.23 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -67.34 -35.07 78.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.998 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.493 ' CD2' ' HZ3' ' A' ' 193' ' ' LYS . 14.2 mt -61.73 -45.55 93.43 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.083 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 55.9 pttt -80.45 -34.28 36.12 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.582 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 42.7 tt0 -69.24 -42.89 75.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.026 -179.33 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.514 ' HD2' ' CE1' ' A' ' 152' ' ' TYR . 10.1 pttm -74.34 -43.2 57.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.524 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -68.6 -40.01 80.65 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.873 -179.726 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.476 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.2 ptm180 -67.6 -39.62 84.78 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 196' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 75.5 p -60.49 -40.79 92.58 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 193' ' ' LYS . 85.6 mt -64.93 -43.42 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.894 178.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -62.58 -42.46 99.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.776 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -65.75 -32.29 73.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.081 178.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.02 -46.18 94.03 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 28.9 mt -63.42 -42.02 98.72 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.028 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.59 -36.58 84.27 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -42.02 98.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.379 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 78.7 mt -61.62 -41.55 97.63 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -64.25 -42.48 96.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.024 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.696 ' O ' ' N ' ' A' ' 210' ' ' GLN . 15.4 mmm180 -65.32 -40.9 94.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.981 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.66 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.2 t -63.77 -45.38 97.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.043 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.9 p -67.85 -28.19 67.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.762 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -101.66 -14.67 17.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.61 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.696 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.6 tt0 -131.59 -28.2 1.86 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.86 0.362 . . . . 0.0 111.107 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.66 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -79.14 25.74 2.62 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.506 ' CE1' ' O ' ' A' ' 127' ' ' SER . 30.7 t80 -60.41 -44.8 95.37 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.747 0.308 . . . . 0.0 110.2 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.483 ' O ' ' OG ' ' A' ' 213' ' ' SER . 0.0 OUTLIER -172.8 18.04 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.03 -179.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 30.9 p -132.54 161.54 33.54 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.743 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -154.62 146.77 23.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.233 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -115.92 172.58 7.06 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.755 0.312 . . . . 0.0 110.946 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -162.44 35.53 0.11 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.652 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.538 ' O ' ' CB ' ' A' ' 219' ' ' GLU . 99.5 m-85 -107.63 140.26 40.91 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.919 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.538 ' CB ' ' O ' ' A' ' 218' ' ' PHE . 8.4 tm-20 92.43 -32.27 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 179.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -60.74 155.59 50.65 Favored Pre-proline 0 N--CA 1.464 0.235 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.203 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.12 119.32 6.51 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 C-N-CA 122.149 1.9 . . . . 0.0 112.051 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 178.63 -93.58 0.0 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.757 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -47.16 93.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.733 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 1.1 mp -65.41 -26.71 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.836 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -67.45 -46.54 72.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 109.767 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 5.0 tp -61.14 -41.27 96.43 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.354 179.302 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 44.2 m0 -60.06 -42.01 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.066 -0.653 . . . . 0.0 109.677 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -65.06 -29.84 70.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 4.0 mt -62.2 -43.26 99.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.872 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.468 ' O ' ' CD2' ' A' ' 235' ' ' LEU . . . -36.07 -42.91 0.31 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.919 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -39.53 -34.24 0.21 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.855 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 39.3 m -130.87 66.14 1.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.532 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . 0.473 ' H ' ' CD1' ' A' ' 235' ' ' LEU . . . -144.2 46.7 1.42 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . 0.411 ' N ' HD11 ' A' ' 235' ' ' LEU . 58.9 t30 63.17 73.56 0.45 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.494 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . 0.58 ' N ' ' CD1' ' A' ' 235' ' ' LEU . 0.3 OUTLIER -108.85 -160.32 0.72 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.095 0.474 . . . . 0.0 110.843 179.719 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 236' ' ' THR . . . . . 0.4 ' OG1' ' CD ' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -131.74 -146.97 0.3 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.746 -179.157 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -101.59 -66.17 0.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.814 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.35 -40.9 97.92 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.446 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . 0.484 ' HA ' ' HB3' ' A' ' 322' ' ' GLU . 34.0 mt-10 -61.93 -35.38 78.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.884 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.15 -46.04 89.05 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.79 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -65.34 -44.81 86.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.473 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . 0.543 ' C ' ' NH1' ' A' ' 319' ' ' ARG . . . -60.27 -41.45 93.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.49 -44.67 93.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.724 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -58.76 -52.98 63.39 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 -178.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -64.96 -36.91 85.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.697 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -61.79 -45.0 95.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.359 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.488 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 1.9 mm? -63.34 -41.23 98.86 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.768 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.74 -39.81 90.08 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.888 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -63.96 -63.04 1.26 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 29.4 t80 -59.78 -45.23 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 0.0 110.924 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.488 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 53.1 tp10 -55.03 -41.58 71.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.15 80.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -59.92 -45.83 91.34 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.838 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . 0.468 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.4 tp -66.84 -42.42 89.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.919 179.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.34 -45.59 92.91 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.713 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.73 -41.58 99.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.29 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -43.45 81.04 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -61.58 -40.79 96.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.212 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . 0.513 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 79.7 t60 -58.96 -47.95 83.29 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.212 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -62.29 -37.04 83.97 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.344 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -43.79 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -61.82 -46.92 87.38 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.805 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . 0.513 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.0 mp0 -63.39 -36.77 84.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.864 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 50.3 tp -61.66 -42.46 98.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.348 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -63.05 -46.8 85.8 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.74 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.6 mt -63.02 -42.98 98.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.965 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.81 83.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.084 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -62.18 -44.88 95.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.35 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -59.24 -46.84 87.42 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.048 0.451 . . . . 0.0 110.344 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -60.48 -40.38 91.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.345 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . 0.4 ' CD2' ' OE2' ' A' ' 275' ' ' GLU . 5.4 tt -59.52 -44.11 93.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -59.37 -44.48 92.73 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.995 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -67.63 -42.62 82.04 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.668 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . 0.465 ' O ' ' CG1' ' A' ' 277' ' ' VAL . . . -60.7 -35.35 76.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.926 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . 0.4 ' OE2' ' CD2' ' A' ' 271' ' ' LEU . 90.7 mt-10 -61.31 -28.83 69.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.843 0.354 . . . . 0.0 110.447 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 97.1 p -89.1 5.91 42.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . 0.465 ' CG1' ' O ' ' A' ' 274' ' ' ALA . 11.8 p -60.88 -44.2 97.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.702 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.442 ' N ' ' CG1' ' A' ' 277' ' ' VAL . . . 134.76 -86.67 0.25 Allowed Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -62.93 -39.96 96.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.721 0.296 . . . . 0.0 110.603 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . 0.54 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 87.91 -106.52 3.22 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 63.16 -53.8 0.19 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.851 0.358 . . . . 0.0 110.568 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . 0.54 ' N ' ' O ' ' A' ' 280' ' ' GLY . 16.4 ptm180 -72.26 -15.42 61.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.509 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.8 t -60.61 -44.95 97.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.43 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.1 t -59.97 -44.9 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.006 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -61.59 -43.21 99.29 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.025 0.44 . . . . 0.0 110.532 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 5.6 t -60.94 -42.35 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.093 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -61.67 -41.72 97.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.279 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -57.62 -53.74 54.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.262 -0.427 . . . . 0.0 109.895 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -64.62 -34.36 78.09 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.211 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -58.21 -46.41 85.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.058 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.78 -40.36 79.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.913 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . 0.4 ' CD1' ' C ' ' A' ' 292' ' ' LEU . 1.3 tp -62.92 -52.86 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.87 -43.28 99.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.149 0.5 . . . . 0.0 110.232 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.01 -36.54 84.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.88 -50.44 65.76 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 110.539 -1.025 . . . . 0.0 110.539 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -59.69 -41.28 90.36 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 5.9 m -59.45 -49.15 78.92 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 120.962 0.41 . . . . 0.0 110.04 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -63.72 -44.29 94.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -57.74 -40.22 79.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.03 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.24 -43.14 99.49 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.855 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.95 -43.4 94.93 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -61.88 -44.45 96.79 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.095 0.474 . . . . 0.0 110.778 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.5 m -60.07 -43.7 95.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.206 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.4 -44.24 92.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.924 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.78 -54.66 43.81 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.076 -179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -62.98 -41.69 99.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.46 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -61.68 -39.15 90.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.047 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . 0.438 ' O ' ' OG ' ' A' ' 312' ' ' SER . 26.0 mt -60.66 -44.55 96.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.439 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . 0.598 ' N ' ' OE1' ' A' ' 309' ' ' GLN . 0.0 OUTLIER -63.12 -49.31 74.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.592 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -63.03 -68.88 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.158 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 1.8 tp -41.68 -46.4 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.704 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 312' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 56.6 m -60.02 -41.8 92.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.514 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.59 -35.96 92.57 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 315' ' ' ILE . 18.1 mmm180 -73.54 -64.69 0.94 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.829 0.314 . . . . 0.0 110.977 -179.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . 0.71 HG22 ' N ' ' A' ' 316' ' ' SER . 0.8 OUTLIER -40.59 -104.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.228 -179.071 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 316' ' ' SER . . . . . 0.71 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.0 OUTLIER 62.37 -5.27 0.18 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.621 ' H ' ' C ' ' A' ' 315' ' ' ILE . 0.1 OUTLIER -173.04 -33.71 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.534 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.537 ' N ' ' HD3' ' A' ' 317' ' ' ARG . . . -165.79 -97.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.562 ' H ' ' HB3' ' A' ' 323' ' ' LEU . 7.7 ptm180 -175.03 156.29 2.13 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . 0.817 ' O ' ' N ' ' A' ' 322' ' ' GLU . 86.4 t60 -25.81 136.98 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 113.863 -1.517 . . . . 0.0 112.955 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.657 ' C ' ' H ' ' A' ' 323' ' ' LEU . 6.8 m120 54.79 -58.99 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.61 0.719 . . . . 0.0 109.099 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.817 ' N ' ' O ' ' A' ' 320' ' ' HIS . 80.2 mm-40 -65.06 36.56 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.283 -1.326 . . . . 0.0 109.909 178.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.657 ' H ' ' C ' ' A' ' 321' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.609 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 t -135.16 141.6 45.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.558 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 74.5 ttt-85 -159.05 99.11 1.5 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.667 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -141.12 142.7 34.06 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.843 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -135.04 133.09 39.01 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.637 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -151.1 146.01 25.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.717 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -82.83 138.93 43.2 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.552 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -73.04 154.76 52.76 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.828 2.352 . . . . 0.0 112.4 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.97 160.03 53.21 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.309 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -63.96 147.14 91.98 Favored 'Trans proline' 0 C--N 1.302 -1.883 0 C-N-CA 122.882 2.388 . . . . 0.0 112.327 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.449 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -171.77 -58.91 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.545 -179.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.449 ' HD2' ' N ' ' A' ' 11' ' ' SER . 29.6 Cg_endo -63.59 -171.18 0.13 Allowed 'Trans proline' 0 N--CA 1.497 1.681 0 C-N-CA 122.447 2.098 . . . . 0.0 112.231 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HG2' ' H ' ' A' ' 15' ' ' GLU . 39.6 ttmt -41.86 113.71 0.46 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.519 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -91.9 14.57 15.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.908 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 13' ' ' LYS . 81.4 tt0 63.8 150.49 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.3 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.8 -142.47 0.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.242 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.79 21.73 6.63 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -51.1 133.85 27.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.855 0.36 . . . . 0.0 110.577 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -65.74 -37.21 85.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.67 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -108.19 177.83 4.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.922 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -64.48 -36.8 85.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.82 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.6 mmm -118.56 148.75 42.33 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.21 0.529 . . . . 0.0 110.788 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.67 -38.12 88.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.694 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.29 -47.59 83.16 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.185 0.517 . . . . 0.0 110.321 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.9 tp -63.14 -38.59 91.78 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.501 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -64.24 -40.02 95.15 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.379 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.7 tp60 -62.81 -42.21 99.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.163 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.412 ' C ' ' CD1' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -62.08 -44.4 96.74 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.016 0.436 . . . . 0.0 109.95 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -60.51 -49.57 77.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.362 0.601 . . . . 0.0 110.385 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -58.22 -38.54 77.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.279 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 tppt? -60.61 -46.06 91.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.179 0.514 . . . . 0.0 110.235 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.46 91.91 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.006 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.586 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 89.2 mt-30 -58.58 -38.64 78.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.194 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.589 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 62.8 ttm-85 -62.47 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.45 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.512 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.589 ' CE1' ' O ' ' A' ' 34' ' ' ARG . 25.9 m80 66.0 113.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.7 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 mt -137.45 154.99 75.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.858 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -43.31 155.1 0.16 Allowed 'Trans proline' 0 C--N 1.311 -1.434 0 C-N-CA 122.657 2.238 . . . . 0.0 112.12 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -65.43 -34.78 42.21 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.648 2.232 . . . . 0.0 112.094 -179.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG21 ' H ' ' A' ' 41' ' ' ARG . 3.0 m -68.02 -47.94 76.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.673 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.498 ' H ' HG21 ' A' ' 40' ' ' VAL . 96.9 mtt180 -66.87 -40.06 87.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.416 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.28 -44.09 97.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.501 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.58 -45.53 90.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.431 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.7 tp10 -66.72 -42.76 85.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.502 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.88 -49.55 74.38 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.728 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -58.94 -40.54 84.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.053 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.646 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.36 -48.82 80.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.682 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.11 -49.31 72.06 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.539 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.6 mt -58.59 -40.62 83.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.145 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.27 -37.37 80.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.981 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.9 mm -63.23 -43.44 98.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.792 179.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.4 ' NE2' ' ND2' ' A' ' 80' ' ' ASN . 99.0 mm-40 -57.14 -45.76 83.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.165 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.94 -49.9 76.08 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.263 0.554 . . . . 0.0 110.133 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -59.53 -44.77 93.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.457 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -61.41 -37.54 83.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -58.45 -47.93 82.38 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.007 0.432 . . . . 0.0 109.864 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.0 mt -60.75 -42.01 96.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.211 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.25 -48.2 82.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.428 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -56.8 -39.28 73.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.253 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm -59.86 -46.64 88.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -60.6 -45.51 93.71 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.471 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.15 -39.55 92.99 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.99 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -58.66 -42.97 89.66 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.433 ' C ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -60.58 -42.64 97.09 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.68 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -69.5 -21.47 63.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.202 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 85.23 14.58 68.61 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.1 -43.5 95.17 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.959 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -78.33 141.13 38.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.541 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -148.58 -46.93 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.627 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -65.76 -32.22 73.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.641 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.23 13.09 69.21 Favored Glycine 0 CA--C 1.527 0.832 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.56 -38.94 86.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.755 0.312 . . . . 0.0 110.332 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.544 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 55.4 mttp -56.78 -57.57 11.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.004 0.43 . . . . 0.0 110.154 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -53.2 -39.14 63.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.183 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.85 -40.25 92.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.272 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.544 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 88.0 mtm180 -63.35 -39.26 94.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.58 -44.5 93.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -47.24 89.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.381 0.61 . . . . 0.0 110.224 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -61.44 -41.93 97.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.119 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.498 ' O ' HG13 ' A' ' 84' ' ' ILE . 38.6 t30 -61.25 -41.03 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.257 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.429 ' C ' ' CD1' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.75 -48.69 80.68 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.191 0.52 . . . . 0.0 110.06 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.75 -39.13 87.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.578 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.2 t -63.52 -45.98 96.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.411 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -60.43 -49.01 86.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.354 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.73 -42.82 85.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.965 0.412 . . . . 0.0 111.069 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.62 -45.82 92.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.549 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.66 -47.46 83.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.602 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.83 -22.35 66.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.128 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 77.15 19.81 76.48 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 43.8 mt -89.09 -1.07 57.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.816 0.341 . . . . 0.0 110.422 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -82.44 57.11 3.53 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.047 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -83.66 -161.5 31.94 Favored Glycine 0 CA--C 1.523 0.556 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.096 -178.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 94' ' ' LYS . 98.8 mttt 62.79 -177.8 0.14 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.371 -0.415 . . . . 0.0 110.37 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 93' ' ' LYS . 48.5 tptt 54.87 114.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.227 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.658 ' C ' ' H ' ' A' ' 97' ' ' ARG . 94.7 m-20 50.08 -165.67 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.876 179.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 65.59 -21.35 0.09 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.311 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.658 ' H ' ' C ' ' A' ' 95' ' ' ASP . 60.0 ttt85 -65.55 -42.63 91.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.885 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.46 ' O ' ' O ' ' A' ' 97' ' ' ARG . 86.7 mt-30 46.77 99.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.131 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 63.4 t -61.91 -45.16 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.277 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.41 ' O ' ' OG ' ' A' ' 101' ' ' SER . 57.7 p -133.49 158.57 42.77 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.483 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 100' ' ' THR . 4.6 m -176.59 -48.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.726 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.484 ' O ' ' OD1' ' A' ' 102' ' ' ASN . 40.3 p30 -75.32 140.97 43.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.588 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.5 m -134.93 57.48 1.81 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.632 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.647 ' C ' ' H ' ' A' ' 106' ' ' GLY . 88.8 mt -97.92 15.59 23.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.797 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.39 -19.94 0.09 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.614 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.647 ' H ' ' C ' ' A' ' 104' ' ' LEU . . . 47.7 94.29 0.01 OUTLIER Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.7 m -121.73 126.13 48.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.756 0.312 . . . . 0.0 110.611 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.444 ' O ' ' O ' ' A' ' 109' ' ' GLU . 72.5 tp60 -150.43 149.97 30.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.319 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.444 ' O ' ' O ' ' A' ' 108' ' ' GLN . 83.6 tt0 59.52 135.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.488 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 109' ' ' GLU . 97.5 m-20 -140.37 124.34 17.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.548 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -101.6 -70.65 0.89 Allowed Glycine 0 CA--C 1.522 0.516 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.508 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -139.58 -171.05 3.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.774 0.321 . . . . 0.0 110.71 -179.853 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.625 ' CG ' ' H ' ' A' ' 114' ' ' ASP . 21.6 p30 -98.25 -78.49 0.49 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.918 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.625 ' H ' ' CG ' ' A' ' 113' ' ' ASP . 21.5 m-20 -48.97 114.08 3.52 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.49 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.77 -35.02 56.97 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.539 2.159 . . . . 0.0 112.219 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -58.52 -45.27 89.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.687 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.2 mt -69.14 -36.07 77.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.005 0.431 . . . . 0.0 110.727 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 93.8 mt-10 -61.05 -34.65 75.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.619 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 71.3 mmtt -59.91 -44.07 94.48 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.468 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.12 -44.44 72.39 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.885 0.374 . . . . 0.0 111.69 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.428 ' HE1' ' HD2' ' A' ' 125' ' ' LYS . 16.4 t-105 -61.57 -46.69 88.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.847 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.573 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.5 m-70 -68.57 -37.61 80.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.768 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.7 OUTLIER -57.31 -51.92 67.42 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.898 -178.543 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.32 -45.99 52.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.999 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.428 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 62.1 tttm -48.54 -44.19 36.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.84 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.403 ' C ' ' H ' ' A' ' 128' ' ' GLY . 21.8 m -108.62 -63.46 1.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.907 -179.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -54.89 -11.73 0.68 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.598 -178.725 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 0.56 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -131.76 -3.09 4.19 Favored Glycine 0 CA--C 1.519 0.301 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' SER . 46.5 mttp 54.69 8.71 0.23 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.223 0.535 . . . . 0.0 109.848 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . 0.56 ' CD1' ' O ' ' A' ' 128' ' ' GLY . 14.2 m-30 -67.82 51.19 0.06 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.821 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.431 ' N ' ' O ' ' A' ' 129' ' ' LYS . 96.8 p -97.63 112.29 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.762 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 122.94 -97.93 0.59 Allowed Glycine 0 CA--C 1.528 0.871 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.299 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.418 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.7 mm-40 -77.74 -44.01 29.11 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.042 -179.135 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.4 mp0 -65.6 -43.87 88.35 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.529 -0.469 . . . . 0.0 109.9 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 130' ' ' PHE . 0.6 OUTLIER -62.04 -41.4 98.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.886 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -63.67 -36.93 85.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.945 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.2 mttt -63.0 -44.1 96.95 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.418 0.628 . . . . 0.0 110.057 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.02 -42.55 94.59 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -66.07 -37.83 86.79 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.619 -0.718 . . . . 0.0 112.687 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.547 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 0.6 OUTLIER -51.85 -41.64 62.0 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 0.7 OUTLIER -70.22 -42.42 72.32 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.539 178.672 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.41 -52.85 63.86 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.209 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.539 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.5 mm? -61.96 -40.64 96.26 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.307 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.547 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 45.2 m170 -53.55 -44.99 69.69 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.474 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.475 ' O ' ' HB ' ' A' ' 149' ' ' VAL . 3.4 m-70 -63.83 -41.63 97.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.572 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 149' ' ' VAL . 16.6 mmmt -60.27 -41.47 93.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.159 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . 0.532 ' HA ' ' HD1' ' A' ' 150' ' ' HIS . 50.5 mt-10 -70.2 -55.49 9.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.558 -179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -63.52 -44.21 94.93 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.406 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.523 ' CG1' ' N ' ' A' ' 150' ' ' HIS . 2.8 p -60.83 -44.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.438 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.696 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 1.2 p-80 -66.15 -33.71 76.4 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.324 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.609 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 91.7 mt-10 -63.33 -39.94 95.94 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.313 -0.555 . . . . 0.0 109.892 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -61.93 -49.4 76.32 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.084 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -68.64 -43.78 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.41 ' O ' ' OG1' ' A' ' 158' ' ' THR . 19.3 t -60.75 -45.07 98.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.096 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.4 mt -63.21 -45.71 90.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.539 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 19.9 mt -65.29 -42.51 93.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.752 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -68.8 -31.09 69.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.193 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 154' ' ' VAL . 66.1 m -68.98 -48.06 64.07 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.97 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.453 ' CD1' ' N ' ' A' ' 160' ' ' SER . 4.3 pp -78.97 -36.96 40.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.821 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.453 ' N ' ' CD1' ' A' ' 159' ' ' LEU . 67.3 m -59.47 -45.59 91.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.867 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 70.3 mtp180 -73.37 -46.73 47.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.206 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' THR . . . . . 0.497 ' C ' ' H ' ' A' ' 164' ' ' GLU . 87.5 m -80.38 164.95 22.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.781 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.46 ' N ' ' CG2' ' A' ' 162' ' ' THR . 78.6 tt0 65.05 -1.24 0.9 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.14 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' GLU . . . . . 0.497 ' H ' ' C ' ' A' ' 162' ' ' THR . 88.4 mt-10 -149.01 23.31 0.96 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.46 179.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' ILE . . . . . 0.462 ' CG2' ' O ' ' A' ' 165' ' ' ILE . 9.9 tp -57.0 123.25 7.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.365 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 165' ' ' ILE . 44.0 m80 -155.41 25.58 0.41 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.355 0.597 . . . . 0.0 109.601 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.431 ' O ' ' O ' ' A' ' 168' ' ' ASN . 81.4 tt0 53.14 73.75 0.34 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.946 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.431 ' O ' ' O ' ' A' ' 167' ' ' GLU . 97.3 m-20 59.52 126.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.843 179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 56.8 t -130.2 133.73 63.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 20.7 tt -131.36 128.47 61.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.596 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 18.3 m -160.31 85.86 1.96 Allowed Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 120.75 0.31 . . . . 0.0 110.177 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -41.08 95.51 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.684 2.256 . . . . 0.0 111.971 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 14.8 t -140.11 140.76 36.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.656 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -59.5 -46.8 87.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.308 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' A' ' 177' ' ' ASP . 84.0 mt -134.3 107.06 7.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.169 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 1.3 m 44.93 -85.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.188 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' ASP . . . . . 0.611 ' N ' ' O ' ' A' ' 175' ' ' LEU . 66.4 t0 -173.95 44.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.681 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.638 ' O ' ' N ' ' A' ' 180' ' ' GLY . 1.1 pp -139.21 39.74 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.582 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 63.8 mttm 59.28 -65.8 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.578 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.638 ' N ' ' O ' ' A' ' 178' ' ' ILE . . . 157.5 53.91 0.01 OUTLIER Glycine 0 CA--C 1.524 0.601 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 83.1 p -121.7 -4.26 9.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.752 0.311 . . . . 0.0 110.735 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.564 ' CG1' ' H ' ' A' ' 183' ' ' LEU . 11.9 t -142.31 178.14 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.614 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.564 ' H ' ' CG1' ' A' ' 182' ' ' VAL . 82.3 mt 60.08 3.82 0.56 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.872 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.672 ' HD1' ' N ' ' A' ' 185' ' ' SER . 1.9 p80 -58.54 -43.27 89.22 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.667 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.672 ' N ' ' HD1' ' A' ' 184' ' ' HIS . 36.2 t -62.36 -44.97 95.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.276 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 186' ' ' ARG . 43.0 ttt85 -60.99 -45.06 96.3 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.994 0.426 . . . . 0.0 110.937 -179.119 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 58.9 m-70 -63.99 -35.04 79.4 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.022 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 51.7 m -61.35 -42.65 99.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.734 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.97 -38.14 89.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.591 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 0.8 OUTLIER -60.98 -45.25 95.55 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.718 179.367 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 63.3 mttp -70.15 -36.1 74.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -68.06 -47.9 67.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.059 0.457 . . . . 0.0 111.741 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.443 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 15.8 pttt -73.13 -41.61 63.78 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.416 -179.219 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.535 ' C ' ' CD1' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.67 -41.11 79.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.063 -179.59 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 195' ' ' ARG . . . . . 0.521 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 36.1 ptt180 -67.57 -39.12 84.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 67.4 m -58.64 -42.38 88.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 91.2 mt -64.14 -43.64 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.429 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -61.1 -40.92 95.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.415 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 199' ' ' GLN . . . . . 0.504 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 94.7 mt-30 -60.51 -40.31 90.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.52 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.6 -41.48 99.58 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 201' ' ' LEU . 1.4 mm? -63.24 -41.17 99.04 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.155 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . 0.551 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.2 OUTLIER -62.61 -37.39 86.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.41 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 203' ' ' ARG . . . . . 0.459 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 8.0 tmm_? -61.46 -43.85 98.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.731 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.1 mt -61.67 -40.26 94.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -64.85 -42.04 95.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.126 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.744 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -61.43 -45.33 94.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.366 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 207' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.296 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.564 ' O ' ' CG ' ' A' ' 212' ' ' TYR . 89.3 p -61.89 -37.33 84.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.543 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -94.33 -43.09 8.57 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.102 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 210' ' ' GLN . . . . . 0.744 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.6 tt0 -87.05 -42.92 12.7 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 211' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -71.98 14.28 2.21 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . 0.564 ' CG ' ' O ' ' A' ' 208' ' ' SER . 2.5 m-85 -103.77 146.72 28.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.126 0.489 . . . . 0.0 111.31 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 36.5 t -62.0 143.98 55.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.83 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 48.9 p -111.32 -164.6 0.93 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.702 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 63.2 157.95 0.07 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.598 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -92.6 169.38 10.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.286 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.5 ' N ' ' OE1' ' A' ' 217' ' ' GLU . 57.0 mp0 -139.45 34.57 2.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 218' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' A' ' 219' ' ' GLU . 45.7 p90 -62.48 -48.54 79.13 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 120.755 0.312 . . . . 0.0 110.406 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 220' ' ' GLU . 11.3 tm-20 -110.86 -78.72 0.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.115 0.483 . . . . 0.0 110.292 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 220' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 0.0 OUTLIER 54.78 169.91 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.988 -179.878 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.557 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 41.4 Cg_exo -55.85 150.86 43.57 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.461 2.107 . . . . 0.0 112.025 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 222' ' ' ARG . . . . . 0.715 ' O ' ' N ' ' A' ' 225' ' ' ASP . 24.1 ttp180 87.51 -139.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.493 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 223' ' ' VAL . . . . . 0.502 ' C ' ' O ' ' A' ' 222' ' ' ARG . 2.5 m 27.77 -104.17 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.207 0.527 . . . . 0.0 110.72 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . 0.456 ' H ' ' CG2' ' A' ' 223' ' ' VAL . 1.3 mp -59.78 -39.05 78.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.787 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 225' ' ' ASP . . . . . 0.715 ' N ' ' O ' ' A' ' 222' ' ' ARG . 55.9 m-20 -62.53 -40.66 97.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.8 tp -60.0 -43.56 95.11 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.338 0.59 . . . . 0.0 109.491 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 227' ' ' TRP . . . . . 0.407 ' CD1' ' N ' ' A' ' 227' ' ' TRP . 26.0 m0 -63.14 -33.95 76.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.695 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -61.42 -38.95 88.98 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 229' ' ' LEU . . . . . 0.513 ' O ' ' N ' ' A' ' 232' ' ' SER . 97.8 mt -63.44 -42.1 98.66 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.787 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 230' ' ' ALA . . . . . 0.498 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -28.3 -44.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.955 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 231' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 229' ' ' LEU . 8.7 tt0 -67.33 -53.56 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.719 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 229' ' ' LEU . 30.2 t -68.61 -18.1 64.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.5 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -69.02 -82.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.657 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -177.6 98.81 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.631 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 53.4 mt -145.09 151.62 38.79 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.1 p -79.62 169.25 18.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.691 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -61.38 -48.24 82.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.829 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -60.28 -49.29 78.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.99 0.424 . . . . 0.0 110.817 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.24 -37.52 85.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.675 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.78 -40.57 95.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.43 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.95 -55.6 31.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.612 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -59.39 -37.13 77.19 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.776 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 243' ' ' PHE . . . . . 0.557 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.4 OUTLIER -63.33 -45.92 89.02 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.938 178.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 244' ' ' ARG . . . . . 0.445 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 45.0 ttm180 -60.91 -45.02 96.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.071 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -65.93 -46.56 77.78 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 51.8 tp10 -59.67 -47.42 85.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . 0.557 HD23 ' O ' ' A' ' 243' ' ' PHE . 2.4 mm? -63.73 -39.39 94.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.798 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 86.5 tttt -54.81 -48.1 73.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.165 0.507 . . . . 0.0 110.115 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -67.74 -37.96 82.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -61.05 -49.56 76.88 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.833 0.349 . . . . 0.0 111.066 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 251' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 16.1 pt-20 -62.41 -35.4 79.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.894 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.11 92.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.386 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.29 -50.78 68.76 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.978 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -30.36 49.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.176 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -64.54 -46.39 83.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 110.172 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -62.89 -44.45 96.06 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.349 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -57.61 -42.99 84.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.253 179.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -61.15 -40.79 95.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.133 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 259' ' ' HIS . . . . . 0.533 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 81.9 t60 -59.43 -47.08 86.86 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.27 0.557 . . . . 0.0 110.279 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -62.44 -36.23 81.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.371 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 261' ' ' GLN . . . . . 0.643 HE21 ' CG2' ' A' ' 297' ' ' THR . 83.2 mm-40 -61.71 -42.37 98.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.214 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -60.62 -47.66 85.21 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 263' ' ' GLN . . . . . 0.533 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 3.7 mp0 -65.78 -37.67 86.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.166 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.73 -43.5 98.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.248 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -62.81 -48.93 76.99 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.13 0.49 . . . . 0.0 110.424 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 70.3 mt -62.3 -43.0 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.901 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.54 76.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -63.88 -49.29 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.279 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.75 -44.03 82.53 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.037 0.446 . . . . 0.0 110.672 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -62.39 -45.75 91.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.572 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 42.8 tp -62.05 -42.46 99.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.785 0.326 . . . . 0.0 110.344 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -57.25 -42.8 82.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.277 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -80.14 -26.92 39.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.528 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.55 -38.14 90.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.735 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -53.73 -20.91 6.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.548 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 73.5 m -62.37 -37.18 84.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.73 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.0 t -61.01 -45.22 98.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.49 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 98.74 17.78 27.24 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -82.5 106.63 14.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.823 0.344 . . . . 0.0 110.462 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.21 91.8 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -61.63 -53.93 49.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.769 0.319 . . . . 0.0 110.632 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -68.2 -43.88 77.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.778 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 283' ' ' VAL . . . . . 0.577 ' CG1' ' NH1' ' A' ' 287' ' ' ARG . 41.8 t -61.85 -48.28 89.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.701 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 42.9 t -62.99 -46.04 89.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.777 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -63.25 -41.33 99.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.788 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 55.4 m -59.64 -45.3 92.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.398 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 287' ' ' ARG . . . . . 0.577 ' NH1' ' CG1' ' A' ' 283' ' ' VAL . 59.6 mtt85 -64.03 -38.16 90.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.975 0.417 . . . . 0.0 110.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -57.76 -60.98 2.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.393 0.616 . . . . 0.0 110.238 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -63.34 -40.46 97.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.043 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -42.62 -52.49 4.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.182 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.09 -37.63 78.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.677 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 292' ' ' LEU . . . . . . . . . . . . . 22.8 tp -61.41 -52.28 65.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.587 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.83 -42.05 97.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.251 0.548 . . . . 0.0 109.991 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . 0.509 ' O ' ' OG1' ' A' ' 297' ' ' THR . 82.3 tt0 -62.25 -35.34 78.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.695 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.47 -44.81 94.69 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -59.58 -43.48 93.63 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.09 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 297' ' ' THR . . . . . 0.643 ' CG2' HE21 ' A' ' 261' ' ' GLN . 36.0 p -60.5 -42.19 95.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.243 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -63.73 -45.12 91.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.434 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -60.92 -44.15 97.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.305 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -42.74 99.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.962 0.411 . . . . 0.0 110.429 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.28 -43.23 95.66 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -62.15 -42.86 99.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.399 . . . . 0.0 110.449 178.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 10.5 m -61.25 -44.96 96.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.482 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.56 -43.27 90.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.972 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -59.33 -49.6 77.2 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.626 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -62.9 -43.56 98.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.341 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 307' ' ' HIS . . . . . 0.538 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.58 -37.05 85.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.138 179.321 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 308' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 312' ' ' SER . 11.8 mt -61.34 -41.87 97.75 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.436 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -68.52 -58.84 3.71 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.05 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.11 -48.79 78.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.265 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 311' ' ' LEU . . . . . 0.538 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 12.4 tp -61.0 -42.78 99.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.703 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 312' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 67.2 p -61.67 -36.11 79.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.519 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.26 -44.96 89.69 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 87.0 mtm180 -63.2 -43.46 98.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.738 0.304 . . . . 0.0 110.855 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 2.1 mm -74.09 -15.79 16.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.692 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 6.1 t -53.49 -48.65 68.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.262 0.553 . . . . 0.0 109.726 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . 0.708 ' C ' ' H ' ' A' ' 319' ' ' ARG . 19.9 ptp180 -109.2 -26.2 10.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.76 -176.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 317' ' ' ARG . . . 70.03 -30.53 0.2 Allowed 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 119.116 -1.033 . . . . 0.0 109.407 -178.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 319' ' ' ARG . . . . . 0.708 ' H ' ' C ' ' A' ' 317' ' ' ARG . 6.3 tpt180 66.18 161.69 0.15 Allowed 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -177.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -65.22 -40.86 94.66 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.101 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 321' ' ' ASN . . . . . 0.597 ' O ' ' N ' ' A' ' 323' ' ' LEU . 64.1 t30 -117.83 158.93 23.92 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 122.205 -0.309 . . . . 0.0 110.569 177.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 322' ' ' GLU . . . . . 0.464 ' O ' ' C ' ' A' ' 323' ' ' LEU . 81.3 tt0 -35.16 88.68 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 O-C-N 122.014 -0.429 . . . . 0.0 110.868 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 323' ' ' LEU . . . . . 0.597 ' N ' ' O ' ' A' ' 321' ' ' ASN . 3.6 mm? . . . . . 0 C--N 1.317 -0.821 0 CA-C-O 118.072 -0.966 . . . . 0.0 111.412 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.653 ' N ' HD22 ' A' ' 26' ' ' ASN . 83.0 m-85 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.719 0.295 . . . . 0.0 110.52 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.485 ' C ' ' SD ' ' A' ' 22' ' ' MET . 73.2 ttp85 -67.77 -18.68 64.95 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.525 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.485 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -115.32 137.14 52.35 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.206 0.526 . . . . 0.0 111.102 -179.761 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.94 -36.49 84.55 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.474 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -60.72 -47.35 86.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.106 0.479 . . . . 0.0 110.26 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.7 mp -61.77 -38.25 87.35 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.653 HD22 ' N ' ' A' ' 20' ' ' PHE . 19.0 m120 -62.32 -40.69 97.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.972 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 82.0 mt-30 -60.84 -45.7 93.48 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.722 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.22 -41.03 96.15 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.032 0.444 . . . . 0.0 109.973 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -57.96 -44.71 87.2 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.121 0.486 . . . . 0.0 109.787 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -60.48 -37.46 81.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.616 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 73.5 mmtt -61.38 -42.53 98.87 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.255 0.55 . . . . 0.0 109.678 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.72 -37.31 86.05 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.149 -0.621 . . . . 0.0 110.113 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -61.15 -46.37 90.82 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.254 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.616 ' HG2' ' O ' ' A' ' 31' ' ' LYS . 53.6 ptt85 -66.19 -35.1 79.57 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.119 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.36 -38.63 91.91 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.051 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.77 110.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.707 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 mt -132.69 154.59 81.54 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.741 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 79.0 Cg_exo -42.54 154.3 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.415 2.077 . . . . 0.0 112.487 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.1 Cg_exo -58.12 -46.86 22.87 Favored 'Trans proline' 0 N--CA 1.497 1.73 0 C-N-CA 122.615 2.21 . . . . 0.0 112.51 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.472 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 62.2 t -64.14 -46.46 93.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.726 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -64.06 -41.86 97.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.133 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.97 -44.2 97.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.61 90.47 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.71 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.472 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 1.7 mp0 -67.73 -46.94 70.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.84 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.533 HD13 ' OH ' ' A' ' 88' ' ' TYR . 55.6 tp -63.16 -46.92 84.91 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.023 0.44 . . . . 0.0 110.489 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 46.4 t60 -59.27 -42.32 90.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.05 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.578 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.62 -47.64 84.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.939 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -56.01 -47.13 78.34 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.68 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.32 -40.86 87.61 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -59.4 -39.34 83.1 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.842 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 47' ' ' ALA . 40.6 mm -62.33 -43.7 98.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -55.5 -44.71 76.84 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.267 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -60.08 -46.53 89.28 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.088 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -60.66 -44.48 96.38 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.364 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -61.07 -37.45 82.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.311 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -60.44 -45.1 94.89 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.26 -42.01 97.9 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.213 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.54 94.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.014 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -58.6 -43.53 89.59 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.759 0.314 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -60.2 -46.57 89.26 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.012 0.434 . . . . 0.0 110.044 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.79 -39.57 94.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.786 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.6 mt -61.57 -43.17 99.36 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.27 -37.02 85.99 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.907 179.879 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.567 0 N-CA-C 110.681 -0.967 . . . . 0.0 110.681 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -64.05 -34.75 78.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.37 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.1 -50.1 75.35 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.088 0.47 . . . . 0.0 109.857 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -61.4 -41.89 97.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.188 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.23 89.85 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.382 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -62.5 -42.74 99.71 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.642 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.16 -43.45 98.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.522 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.9 -44.53 98.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 121.094 0.473 . . . . 0.0 109.966 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.758 ' O ' HG23 ' A' ' 83' ' ' VAL . 20.7 mmm180 -59.87 -41.12 90.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.098 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.78 -39.34 94.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.39 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.43 -49.14 78.95 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.39 -179.58 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -64.31 -39.02 93.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.512 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 79' ' ' ARG . 70.7 t -62.18 -46.21 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.835 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.7 mt -61.53 -47.66 92.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.183 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.3 -39.63 92.74 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.648 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.49 93.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.545 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.66 -44.54 96.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.693 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.533 ' OH ' HD13 ' A' ' 45' ' ' LEU . 12.2 m-85 -69.49 -26.0 64.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.32 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.03 28.07 71.05 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 120.898 0.38 . . . . 0.0 110.68 179.899 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 98.3 mt . . . . . 0 C--O 1.233 0.213 0 CA-C-O 120.976 0.417 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -62.13 -30.39 71.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.579 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.1 mttt -62.93 -50.45 70.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.747 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 120' ' ' LEU . 32.5 mt -68.08 -43.83 77.63 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.882 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.0 t-105 -60.41 -51.3 70.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 -179.201 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -70.08 -37.55 75.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.026 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.759 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.5 OUTLIER -55.45 -50.87 68.71 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.463 -178.877 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.95 ' HB1' ' CG ' ' A' ' 130' ' ' PHE . . . -72.5 -46.93 52.4 Favored 'General case' 0 C--O 1.246 0.886 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.288 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.404 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 55.8 tttm -47.15 -33.91 5.64 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.46 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -106.15 -35.43 7.22 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.986 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.576 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 36.9 m -50.72 -24.84 3.69 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.279 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -153.89 -95.8 0.12 Allowed Glycine 0 CA--C 1.525 0.703 0 C-N-CA 119.686 -1.245 . . . . 0.0 111.824 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.738 ' O ' ' N ' ' A' ' 131' ' ' SER . 68.8 mttm -150.93 25.27 0.74 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.372 0.605 . . . . 0.0 110.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.95 ' CG ' ' HB1' ' A' ' 124' ' ' ALA . 21.9 m-85 -49.72 60.82 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.186 -1.37 . . . . 0.0 111.14 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.738 ' N ' ' O ' ' A' ' 129' ' ' LYS . 30.3 p -70.1 146.44 50.89 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.446 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . -37.03 -18.56 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.178 -173.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.632 ' N ' ' O ' ' A' ' 131' ' ' SER . 48.8 mt-10 -74.31 -46.14 42.9 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 118.927 -1.109 . . . . 0.0 108.497 176.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' A' ' 131' ' ' SER . 80.4 mm-40 -75.62 -42.36 51.85 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.354 178.333 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.882 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -60.07 -37.47 79.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.446 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 54.5 m-20 -61.92 -43.94 97.8 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.362 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -58.92 -45.16 91.05 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 119.881 -0.727 . . . . 0.0 109.9 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.489 HD13 ' OE2' ' A' ' 141' ' ' GLU . 4.5 mm? -61.01 -40.37 93.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 178.396 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.591 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -65.12 -31.53 72.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 176.876 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.567 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 84.5 mmt-85 -57.6 -48.51 79.19 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.245 -0.982 . . . . 0.0 108.358 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.83 ' OE1' HD21 ' A' ' 204' ' ' LEU . 9.4 pt-20 -71.46 -34.16 69.98 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.964 -0.694 . . . . 0.0 111.912 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.591 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.2 m-85 -56.15 -58.78 6.48 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.184 0.516 . . . . 0.0 110.242 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.41 -37.59 86.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.214 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 67.4 m170 -51.51 -42.7 61.9 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 119.677 -0.809 . . . . 0.0 109.388 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.88 -41.67 91.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.396 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -61.29 -44.15 97.7 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.31 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -68.05 -49.19 62.9 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -61.37 -42.91 99.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.606 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.06 -45.09 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.542 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.689 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.4 m170 -61.12 -35.96 78.45 Favored 'General case' 0 C--O 1.215 -0.742 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.294 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -65.21 -46.68 79.69 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.191 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.416 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 42.1 m-85 -65.69 -44.02 87.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.837 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -70.44 -45.2 66.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.667 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 150' ' ' HIS . 75.9 t -63.12 -45.96 97.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.905 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 73.4 mt . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.42 179.21 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 . . . . . 0 CA--C 1.522 -0.123 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.588 HD23 ' NZ ' ' A' ' 193' ' ' LYS . 8.5 mt -61.97 -47.85 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.592 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.465 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.7 mtpt -68.59 -40.88 80.32 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.438 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -68.76 -44.95 72.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.883 -178.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.588 ' NZ ' HD23 ' A' ' 190' ' ' LEU . 1.8 pttm -71.57 -44.46 64.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.233 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.701 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -69.36 -42.82 74.72 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.32 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.548 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.99 -37.56 88.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' ' 195' ' ' ARG . 69.3 m -62.18 -44.32 96.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -65.38 -43.71 94.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.983 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -63.06 -42.47 99.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.822 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -66.04 -33.12 75.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.334 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.95 -49.51 74.83 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 201' ' ' LEU . 23.0 mt -63.49 -40.46 97.15 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.961 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.8 -37.41 84.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -42.83 99.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.238 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.83 HD21 ' OE1' ' A' ' 141' ' ' GLU . 21.0 mt -61.51 -41.48 97.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -64.52 -42.94 95.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.803 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.711 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -65.99 -40.29 91.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.565 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.521 ' O ' ' N ' ' A' ' 211' ' ' GLY . 22.0 t -63.65 -46.82 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.86 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.8 p -72.07 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.058 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -100.5 -14.76 18.12 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.318 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.711 ' N ' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -130.75 -39.53 1.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.045 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.503 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 219' ' ' GLU . 73.8 tt0 . . . . . 0 CA--C 1.531 0.228 0 CA-C-O 120.678 0.275 . . . . 0.0 110.72 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -61.33 139.86 94.66 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.521 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.425 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 68.9 Cg_endo -76.88 14.63 1.25 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.582 2.188 . . . . 0.0 111.919 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -105.94 -62.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.319 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.494 HG13 ' H ' ' A' ' 224' ' ' ILE . 0.5 OUTLIER -61.11 -55.31 25.48 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 CA-C-O 121.073 0.464 . . . . 0.0 111.619 -179.326 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.494 ' H ' HG13 ' A' ' 223' ' ' VAL . 2.9 mm -62.75 -41.5 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 225' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 47.8 t0 -62.58 -37.7 87.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.95 0.405 . . . . 0.0 109.938 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 6.0 tp -60.19 -43.49 95.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.449 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 46.2 m0 -60.26 -38.63 84.11 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.054 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 228' ' ' ASP . . . . . 0.511 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 45.1 t0 -61.64 -33.83 74.63 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 178.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.647 ' O ' ' N ' ' A' ' 232' ' ' SER . 38.6 mt -64.32 -40.08 95.19 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.071 0.463 . . . . 0.0 110.695 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.521 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -24.58 -51.77 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.092 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.511 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 1.1 pt20 -58.27 -44.81 88.57 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.232 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.647 ' N ' ' O ' ' A' ' 229' ' ' LEU . 9.9 m -79.97 -7.54 58.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.377 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -81.91 10.73 5.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.928 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.6 m120 67.56 91.28 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.31 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 79.7 mt -129.73 166.34 20.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.701 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.0 p -73.46 161.56 30.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.722 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -63.99 -46.28 85.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.57 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -62.68 -46.71 86.92 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.993 0.425 . . . . 0.0 110.524 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -67.44 -37.96 83.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.557 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -63.07 -42.58 99.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.731 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -64.77 -52.83 54.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.522 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.59 -37.77 76.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.468 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -66.7 -44.14 82.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.853 178.789 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -57.3 -47.93 80.22 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.902 0.382 . . . . 0.0 110.264 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.96 -38.81 83.22 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.814 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -60.02 -49.6 77.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.944 0.402 . . . . 0.0 110.492 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.505 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 4.0 mm? -63.78 -40.33 96.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.976 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.5 -44.25 84.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.923 0.392 . . . . 0.0 110.037 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -67.01 -41.16 87.17 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.714 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -59.4 -48.89 79.9 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 120.739 0.304 . . . . 0.0 111.282 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 12.4 pt-20 -65.1 -37.65 88.17 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.76 -40.08 88.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.743 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -62.85 -45.39 92.78 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.428 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -65.05 -40.3 88.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.079 -0.649 . . . . 0.0 109.832 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.81 -44.56 96.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -61.82 -42.41 98.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.102 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 257' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -56.11 -45.49 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.24 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 258' ' ' ASN . . . . . 0.401 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 53.8 t-20 -59.13 -41.95 89.47 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.362 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -59.02 -45.52 90.5 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.371 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -62.18 -38.26 88.41 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.148 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -59.7 -42.28 92.64 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.049 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -62.07 -47.74 83.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.419 -0.513 . . . . 0.0 109.848 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -65.24 -34.09 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.111 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.43 -42.13 99.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.89 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -64.19 -47.6 79.13 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.05 -43.42 99.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.1 -38.17 82.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.975 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.82 -44.29 97.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.955 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 269' ' ' GLU . . . . . 0.543 ' OE2' ' NE2' ' A' ' 273' ' ' HIS . 17.3 tp10 -59.83 -44.84 93.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.136 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.09 -39.43 89.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 28.3 tp -60.3 -44.75 95.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.072 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 272' ' ' ARG . . . . . 0.425 ' NH2' ' OE1' ' A' ' 269' ' ' GLU . 86.6 mtm180 -61.15 -42.07 97.89 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.095 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 273' ' ' HIS . . . . . 0.543 ' NE2' ' OE2' ' A' ' 269' ' ' GLU . 18.1 m170 -67.85 -43.09 80.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.214 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.64 84.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.886 0.374 . . . . 0.0 110.939 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -64.3 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 7.8 t -61.95 -20.44 63.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.78 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.458 HG12 ' H ' ' A' ' 279' ' ' ASP . 91.5 t -61.3 -46.26 96.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.884 0.373 . . . . 0.0 110.413 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.72 58.04 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 279' ' ' ASP . . . . . 0.458 ' H ' HG12 ' A' ' 277' ' ' VAL . 91.1 m-20 -68.07 -24.06 65.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.602 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 83.78 5.74 87.73 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 281' ' ' GLU . . . . . 0.681 ' C ' ' H ' ' A' ' 283' ' ' VAL . 75.0 mm-40 -82.91 156.92 23.28 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 110.026 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 61.2 -17.8 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.732 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 283' ' ' VAL . . . . . 0.681 ' H ' ' C ' ' A' ' 281' ' ' GLU . 73.7 t -63.25 -47.4 92.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.66 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 5.9 t -64.3 -46.22 84.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.485 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -62.96 -46.25 88.62 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.927 0.394 . . . . 0.0 110.79 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 m -61.58 -42.09 98.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.529 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -64.32 -39.03 93.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.38 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -60.71 -55.3 34.84 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.751 ' HD3' HD23 ' A' ' 292' ' ' LEU . 8.1 mmtp -64.02 -32.8 74.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.375 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 290' ' ' HIS . . . . . 0.572 ' CE1' ' OE2' ' A' ' 294' ' ' GLU . 19.9 t-80 -57.82 -49.86 75.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.351 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.27 -39.12 82.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.746 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.751 HD23 ' HD3' ' A' ' 289' ' ' LYS . 4.4 tp -61.5 -47.13 87.02 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.341 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 1.1 mt -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.058 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.572 ' OE2' ' CE1' ' A' ' 290' ' ' HIS . 92.1 mt-10 -64.2 -36.14 83.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.12 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.92 89.42 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 296' ' ' ARG . . . . . 0.521 ' NH1' ' OE1' ' A' ' 299' ' ' GLU . 14.2 tpp180 -62.81 -42.7 99.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.682 0.277 . . . . 0.0 110.744 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 23.4 p -59.06 -50.04 75.61 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.427 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -63.07 -43.2 99.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.529 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 299' ' ' GLU . . . . . 0.521 ' OE1' ' NH1' ' A' ' 296' ' ' ARG . 83.6 tt0 -62.0 -40.54 96.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.294 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.61 95.64 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.267 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.65 -41.59 97.46 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 302' ' ' TYR . . . . . 0.469 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 70.1 t80 -62.15 -45.54 92.96 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.53 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 8.9 m -60.44 -43.4 96.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.447 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.97 -43.25 91.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 52.0 tttp -56.32 -50.41 71.55 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.342 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 306' ' ' LYS . . . . . 0.469 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 30.9 mtpt -62.78 -42.35 99.66 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.49 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -61.78 -37.97 86.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.449 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 9.4 mt -61.02 -44.61 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.277 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -68.96 -45.69 70.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.068 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -62.73 -52.07 64.68 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.536 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.04 -38.7 91.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.504 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.0 m -58.38 -44.61 88.99 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.381 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -73.06 -47.28 24.83 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.135 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -63.6 -45.44 90.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.743 0.306 . . . . 0.0 110.521 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 315' ' ' ILE . . . . . 0.551 ' O ' ' C ' ' A' ' 316' ' ' SER . 2.5 mm -70.48 -27.02 29.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.576 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 316' ' ' SER . . . . . 0.551 ' C ' ' O ' ' A' ' 315' ' ' ILE . 23.1 t -37.15 -48.62 0.84 Allowed 'General case' 0 CA--C 1.486 -1.517 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 . . . . . 0 N--CA 1.428 -1.557 0 C-N-CA 116.297 -2.161 . . . . 0.0 113.249 173.39 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 1.066 ' N ' HD22 ' A' ' 26' ' ' ASN . 33.5 m-85 . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.74 0.305 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.19 -19.1 61.79 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.826 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.2 mmm -135.1 148.0 49.69 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.242 0.544 . . . . 0.0 110.916 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -64.36 -37.16 86.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.486 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.7 -48.59 80.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.117 0.484 . . . . 0.0 110.45 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.16 -38.32 86.03 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.496 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 1.066 HD22 ' N ' ' A' ' 20' ' ' PHE . 19.3 m120 -63.27 -39.94 95.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.196 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -61.65 -43.9 97.98 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.282 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 2.3 mm? -62.6 -43.17 99.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.514 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 48.0 t-105 -63.01 -50.63 69.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.469 0.652 . . . . 0.0 110.346 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -56.91 -39.05 73.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.846 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -61.07 -44.37 97.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.024 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.82 88.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.806 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.514 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 76.1 mt-30 -61.14 -38.24 85.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.946 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 mmm-85 -64.12 -39.27 93.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.545 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 35' ' ' LEU . 88.8 mt -66.04 -32.54 74.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.397 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.422 ' ND1' ' O ' ' A' ' 33' ' ' GLN . 56.5 m-70 65.86 113.87 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.752 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.2 mt -138.38 154.49 73.68 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.753 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -42.01 154.6 0.1 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.454 2.102 . . . . 0.0 112.321 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -69.41 -40.35 5.99 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.548 2.165 . . . . 0.0 112.454 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 63.1 t -63.21 -48.92 85.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.578 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -66.31 -39.42 89.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.447 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.26 -41.84 99.08 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.552 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.44 78.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.52 -42.63 87.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.9 tp -62.45 -47.46 83.94 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.152 0.501 . . . . 0.0 110.748 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.6 t60 -61.03 -41.57 96.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.273 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.565 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.16 -48.37 81.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.727 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -54.11 -48.5 70.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.865 0.364 . . . . 0.0 110.251 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.82 -40.07 83.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -59.94 -40.01 87.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.565 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.3 mm -62.53 -42.9 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.81 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -59.67 -45.49 91.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.351 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -57.4 -48.0 80.22 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.346 0.593 . . . . 0.0 110.114 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -59.57 -43.97 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.311 0.577 . . . . 0.0 110.267 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -60.67 -40.16 91.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -58.29 -46.03 86.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.194 0.521 . . . . 0.0 109.848 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.87 -42.63 94.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.998 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.87 -45.2 95.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.549 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 82.2 t90 -56.09 -42.53 76.89 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.283 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.3 -45.95 91.58 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.205 0.526 . . . . 0.0 109.715 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -57.1 -44.63 83.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.11 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.3 mp -62.37 -40.11 95.36 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.021 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -56.46 -44.67 80.77 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 27.0 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.254 179.19 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.806 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -59.69 -39.1 83.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 110.201 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -56.93 -64.26 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.079 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -48.0 -40.38 22.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.216 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.33 86.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.225 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.7 ttt85 -61.34 -41.1 96.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.442 ' N ' HD12 ' A' ' 77' ' ' LEU . 11.0 mp -61.89 -44.15 97.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.146 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.41 -45.77 92.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.293 0.568 . . . . 0.0 109.97 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 83' ' ' VAL . 40.7 mmm-85 -61.79 -38.9 89.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.962 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.4 ' O ' HG13 ' A' ' 84' ' ' ILE . 14.8 t-20 -64.02 -40.48 96.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.185 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.563 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -59.64 -49.86 76.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.311 0.577 . . . . 0.0 109.97 -179.392 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -66.17 -37.51 85.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.549 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.4 t -62.52 -46.57 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.653 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 80' ' ' ASN . 80.4 mt -61.35 -46.95 95.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.391 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 85' ' ' LEU . 29.6 mt -65.31 -39.35 92.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.911 0.386 . . . . 0.0 110.555 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.34 -48.21 82.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.866 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.405 ' HZ2' HG13 ' A' ' 83' ' ' VAL . 47.3 mttp -62.73 -45.33 93.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.776 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -64.35 -30.21 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.376 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.31 9.67 83.41 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 90' ' ' LEU . 95.8 mt . . . . . 0 C--N 1.333 -0.144 0 CA-C-O 120.811 0.338 . . . . 0.0 110.349 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 C--O 1.236 0.384 0 CA-C-O 121.081 0.467 . . . . 0.0 110.439 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.409 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 98.0 mt-10 -55.89 -24.86 39.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.428 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.55 -49.87 74.93 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.78 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.928 HD22 ' CZ ' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -71.42 -46.68 59.5 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.146 0.498 . . . . 0.0 111.782 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.718 ' CE3' HD22 ' A' ' 135' ' ' LEU . 19.3 t-105 -55.89 -46.06 78.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.506 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.409 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.1 m80 -71.19 -34.07 70.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.539 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.577 ' O ' ' OG ' ' A' ' 127' ' ' SER . 10.3 tptt -55.54 -51.38 67.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.079 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -75.34 -47.15 29.05 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.974 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HB2' HD11 ' A' ' 135' ' ' LEU . 65.6 tttm -50.77 -39.55 52.69 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.747 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.3 m -94.1 -41.72 9.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.875 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.577 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 15.8 m -44.6 -27.11 0.44 Allowed 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.444 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -156.54 -97.08 0.13 Allowed Glycine 0 N--CA 1.462 0.373 0 C-N-CA 119.611 -1.281 . . . . 0.0 111.128 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.679 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.6 mttt -157.46 20.76 0.29 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.579 ' CE1' ' OE1' ' A' ' 134' ' ' GLU . 3.2 m-85 -60.12 50.05 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.671 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.679 ' N ' ' O ' ' A' ' 129' ' ' LYS . 0.1 OUTLIER -107.89 114.94 29.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.983 0.42 . . . . 0.0 111.705 -179.285 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.476 ' O ' ' HB3' ' A' ' 136' ' ' ASP . . . 120.51 -98.06 0.67 Allowed Glycine 0 CA--C 1.524 0.641 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.136 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.563 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 54.2 mp0 -78.79 -40.03 34.21 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.2 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.579 ' OE1' ' CE1' ' A' ' 130' ' ' PHE . 44.2 mt-10 -64.15 -43.55 94.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.563 0.697 . . . . 0.0 110.008 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.718 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -68.77 -35.62 77.29 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.275 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.517 ' CG ' ' N ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -62.36 -49.03 77.18 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.367 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 136' ' ' ASP . 18.6 ptpt -59.96 -38.52 82.73 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.478 ' N ' ' HG3' ' A' ' 137' ' ' LYS . 6.6 mt -59.84 -42.61 94.0 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.24 -39.19 78.64 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.583 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 81.9 mtp180 -54.45 -42.95 71.21 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.125 -1.03 . . . . 0.0 108.397 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -72.2 -39.4 68.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.728 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.928 ' CZ ' HD22 ' A' ' 120' ' ' LEU . 0.2 OUTLIER -59.76 -58.95 6.34 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.722 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.1 -41.01 97.76 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.583 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 36.4 m170 -57.62 -41.4 81.25 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.534 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.593 ' CE1' HG23 ' A' ' 197' ' ' ILE . 10.5 m-70 -64.33 -39.7 94.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.627 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -59.55 -47.64 84.75 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.488 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -68.43 -53.48 23.31 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.631 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.56 -40.93 96.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.997 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 145' ' ' HIS . 41.3 t -62.59 -44.17 99.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.173 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.689 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 0.8 OUTLIER -65.58 -38.96 91.02 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.576 -0.85 . . . . 0.0 109.312 -178.966 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.68 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 97.1 mt-10 -58.87 -45.94 88.98 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.125 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.499 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 2.5 m-85 -62.55 -43.6 98.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.654 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.99 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.049 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 150' ' ' HIS . 12.8 t -60.24 -46.4 94.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 0.0 110.643 179.79 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 . . . . . 0 CA--C 1.515 -0.389 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 4.6 mp -62.34 -41.89 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.033 0.444 . . . . 0.0 110.51 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -68.78 -33.78 74.46 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.846 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.609 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -67.8 -46.07 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.142 0.496 . . . . 0.0 111.685 -179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.413 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 pttt -72.03 -44.67 63.02 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.764 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.01 -41.3 97.51 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.558 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.609 ' HG3' ' O ' ' A' ' 192' ' ' GLU . 0.4 OUTLIER -66.04 -35.6 80.98 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.457 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 55.6 p -59.93 -39.68 86.33 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.593 HG23 ' CE1' ' A' ' 145' ' ' HIS . 70.2 mt -63.84 -43.59 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.26 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -62.25 -41.05 98.09 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.48 0.657 . . . . 0.0 109.303 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.421 ' HA ' ' OD2' ' A' ' 202' ' ' ASP . 25.4 mt-30 -61.95 -39.26 91.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.091 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.74 -39.63 95.54 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.72 -42.59 99.73 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.75 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 0.5 OUTLIER -63.1 -37.17 86.13 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.099 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.579 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 1.9 tmm_? -63.26 -41.75 99.08 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.325 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.83 -40.55 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.157 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.86 -43.68 98.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.511 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.682 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.1 mtt180 -63.7 -37.01 85.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.186 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.536 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 45.2 t -63.6 -45.33 97.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.093 0.473 . . . . 0.0 110.134 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -67.0 -29.38 69.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.63 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -94.32 -45.41 7.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.531 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 206' ' ' ARG . 46.1 tt0 -98.83 -31.4 11.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.141 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.536 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 . . . . . 0 N--CA 1.469 0.48 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.87 158.24 54.53 Favored Pre-proline 0 N--CA 1.464 0.24 0 C-N-CA 120.776 -0.369 . . . . 0.0 110.556 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -54.65 128.38 30.06 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.391 2.061 . . . . 0.0 112.087 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.665 ' HE ' HG23 ' A' ' 223' ' ' VAL . 62.7 ttp180 179.05 -95.88 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.519 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.665 HG23 ' HE ' ' A' ' 222' ' ' ARG . 5.0 t -61.53 -51.38 73.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-O 121.548 0.69 . . . . 0.0 110.585 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.421 HG13 ' CZ3' ' A' ' 227' ' ' TRP . 1.7 mt -66.05 -28.41 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.749 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -63.79 -40.7 97.29 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.464 ' HA ' HD12 ' A' ' 229' ' ' LEU . 13.7 mt -62.31 -40.94 97.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.026 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.547 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 20.6 m0 -59.52 -38.6 81.39 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.095 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 228' ' ' ASP . . . . . 0.492 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 46.3 m-20 -63.5 -38.18 90.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.567 ' O ' ' N ' ' A' ' 232' ' ' SER . 89.1 mt -62.39 -41.55 98.74 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.129 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.481 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -32.75 -34.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.074 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.552 ' CG ' ' N ' ' A' ' 232' ' ' SER . 7.6 pt20 -66.26 -46.24 77.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.728 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.567 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.0 m -89.1 -6.75 56.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.362 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -72.99 9.54 1.15 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 234' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 232' ' ' SER . 58.8 t30 69.19 89.84 0.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.165 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.481 HD12 ' O ' ' A' ' 230' ' ' ALA . 79.6 mt -132.03 -173.25 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.687 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 62.1 p -84.38 164.77 18.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.6 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 237' ' ' ASP . . . . . 0.477 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 21.7 p-10 -73.81 -46.2 46.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.61 -46.58 89.21 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.171 0.51 . . . . 0.0 110.469 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 239' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 243' ' ' PHE . 82.7 tt0 -61.22 -35.82 78.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.707 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 231' ' ' GLN . 2.8 mt -64.56 -39.76 94.33 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.69 -52.55 62.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.25 95.33 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.583 -0.447 . . . . 0.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.489 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.2 OUTLIER -70.02 -32.88 71.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.304 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -62.56 -55.75 24.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.125 0.488 . . . . 0.0 110.31 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -65.51 -37.46 86.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.541 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -56.76 -50.21 72.95 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.218 0.532 . . . . 0.0 110.377 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.514 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.0 mm? -63.96 -39.54 94.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.741 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -54.76 -47.27 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.146 0.498 . . . . 0.0 110.475 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -67.32 -39.39 85.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.614 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -59.69 -49.77 76.46 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.018 0.437 . . . . 0.0 111.364 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.0 pt-20 -63.72 -37.34 86.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.932 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.86 88.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -61.42 -51.47 68.62 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.093 0.473 . . . . 0.0 111.006 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -66.31 -35.35 74.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.201 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.72 -44.54 95.94 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.324 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.2 -43.96 97.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.02 -44.36 82.79 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.093 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -60.91 -40.49 93.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.45 -48.59 81.08 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 110.444 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -62.81 -35.66 80.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -60.88 -44.48 97.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.183 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.98 -48.3 80.95 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.8 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -64.16 -34.1 77.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.866 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.25 -41.97 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.856 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.16 -45.5 84.68 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.554 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.2 mt -62.63 -43.4 98.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.118 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.36 88.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.209 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -60.92 -46.02 92.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.12 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.22 -45.99 91.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.136 0.493 . . . . 0.0 110.279 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.75 -40.14 94.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.447 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.722 HD23 ' O ' ' A' ' 271' ' ' LEU . 5.0 tt -59.17 -43.69 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.095 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -62.31 -41.08 98.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.269 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -66.81 -44.22 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.42 -36.92 85.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.627 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.03 -26.08 68.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 35.9 t -60.58 -39.83 89.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.376 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.42 -43.48 94.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.275 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.71 8.93 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -63.8 -42.88 97.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.732 0.301 . . . . 0.0 110.654 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 70.26 -3.85 9.96 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -96.98 -56.58 2.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 110.472 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -80.88 -15.95 54.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.746 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.51 -47.13 93.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.655 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 43.8 t -63.87 -43.99 94.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -59.73 -47.49 85.43 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.589 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 286' ' ' SER . . . . . 0.45 ' OG ' HD12 ' A' ' 271' ' ' LEU . 15.2 t -63.03 -45.87 90.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -63.96 -38.82 92.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.669 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.97 -57.85 11.26 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.155 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.644 ' HD3' HD23 ' A' ' 292' ' ' LEU . 24.3 mmtt -64.32 -35.58 81.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.12 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -51.41 -52.95 41.6 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.268 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.25 -36.16 79.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.663 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.644 HD23 ' HD3' ' A' ' 289' ' ' LYS . 10.9 tp -60.74 -52.03 66.83 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.374 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 293' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 293' ' ' LEU . 14.8 tp -62.74 -42.85 99.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.451 0.643 . . . . 0.0 109.923 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.626 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.6 tt0 -64.7 -33.24 75.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.876 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -65.08 -47.58 80.29 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 296' ' ' ARG . . . . . 0.526 ' HG3' ' N ' ' A' ' 297' ' ' THR . 0.0 OUTLIER -62.36 -36.98 83.93 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.626 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 16.1 p -61.51 -44.11 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.43 -43.72 98.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.215 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.66 -37.7 88.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.122 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 300' ' ' LEU . . . . . 0.517 ' O ' HD13 ' A' ' 300' ' ' LEU . 0.2 OUTLIER -62.64 -44.46 96.23 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.1 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.31 99.57 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -60.22 -44.56 95.08 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.144 0.497 . . . . 0.0 110.365 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.0 m -61.04 -42.76 99.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.381 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.1 -43.16 88.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.031 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -59.91 -49.75 76.47 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.203 0.525 . . . . 0.0 110.464 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -63.3 -42.42 99.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.55 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.496 ' O ' ' HB2' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.35 -37.5 87.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.898 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.447 ' O ' ' CB ' ' A' ' 312' ' ' SER . 12.2 mt -61.52 -42.45 98.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.489 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -65.78 -60.75 2.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.96 0.41 . . . . 0.0 111.374 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -60.63 -48.34 82.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.392 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 307' ' ' HIS . 9.1 tp -61.72 -40.73 96.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.563 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 312' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 11.4 t -59.2 -44.69 92.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.346 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.35 -38.02 95.75 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -63.15 -45.05 93.7 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.6 mm -71.84 -25.52 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.88 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 316' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' A' ' 317' ' ' ARG . 28.0 p -44.03 -61.31 1.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.498 ' N ' ' OG ' ' A' ' 316' ' ' SER . 7.3 ptt-85 . . . . . 0 C--N 1.331 -0.224 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.461 0.107 0 CA-C-O 120.661 0.267 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -87.64 -12.2 46.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.512 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 78.5 mtp -119.42 138.5 53.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.109 0.48 . . . . 0.0 111.04 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -64.44 -36.53 84.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.44 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.94 -48.31 82.23 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.545 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.449 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.0 mp -61.73 -38.36 87.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.477 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 55.5 t-20 -63.18 -39.24 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.094 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.8 tp60 -60.25 -46.55 89.41 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.348 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.72 -42.47 98.99 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.352 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -61.59 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.176 0.512 . . . . 0.0 110.533 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -58.46 -44.03 89.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.128 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.21 -41.59 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.367 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.0 88.48 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.075 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -62.06 -39.61 92.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.853 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -61.7 -41.49 97.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.347 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.16 -39.63 95.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 65.91 107.96 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.821 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -125.08 154.6 71.52 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.678 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.412 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 82.8 Cg_exo -42.93 154.88 0.13 Allowed 'Trans proline' 0 N--CA 1.492 1.382 0 C-N-CA 122.507 2.138 . . . . 0.0 112.372 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 32.2 Cg_exo -56.01 -43.81 53.16 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.585 2.19 . . . . 0.0 112.209 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.472 ' H ' HG22 ' A' ' 40' ' ' VAL . 2.8 m -67.36 -46.06 84.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.996 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.6 mmt85 -65.37 -42.1 93.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.805 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 tp -63.92 -43.99 94.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.593 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.79 -42.76 90.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.675 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -66.96 -46.24 75.27 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.3 tp -62.94 -45.7 91.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.359 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -59.5 -41.96 91.09 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.983 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.51 -47.36 85.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.657 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -57.0 -47.21 81.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.365 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.4 mt -57.06 -41.99 79.73 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.224 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.63 -38.79 85.96 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.228 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 47' ' ' ALA . 4.9 mm -61.34 -43.32 96.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -58.16 -47.66 82.68 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.622 179.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.26 -47.4 81.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.154 0.502 . . . . 0.0 110.237 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.47 HH11 ' HD3' ' A' ' 54' ' ' ARG . 39.3 mtp-105 -62.0 -41.97 98.63 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.611 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -63.59 -36.81 85.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.413 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -60.66 -49.19 78.53 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.012 0.434 . . . . 0.0 109.999 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.83 -41.18 97.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.259 -0.577 . . . . 0.0 110.089 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.56 96.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.7 t90 -59.7 -42.59 93.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.729 0.299 . . . . 0.0 110.45 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -60.49 -45.61 93.12 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.771 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -60.72 -41.81 96.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.839 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.4 mt -61.05 -41.23 96.21 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.8 -38.91 86.97 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.684 ' O ' HD23 ' A' ' 64' ' ' LEU . 4.3 tt . . . . . 0 C--N 1.329 -0.289 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.654 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.44 -37.75 87.11 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.451 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.416 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 87.4 mttt -54.4 -53.91 47.75 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.003 0.43 . . . . 0.0 110.122 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -60.92 -39.13 88.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.93 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.59 -39.88 95.13 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.475 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.416 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 81.6 mtm180 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.527 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 83.8 mt -63.09 -44.97 94.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.211 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.7 -46.34 89.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-O 121.152 0.501 . . . . 0.0 110.375 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.581 ' O ' HG23 ' A' ' 83' ' ' VAL . 18.6 tpt180 -60.09 -43.8 95.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.977 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -61.73 -40.09 93.86 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.448 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.606 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.73 -48.73 80.5 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.717 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -65.17 -38.17 89.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.507 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 79' ' ' ARG . 55.2 t -62.93 -46.89 95.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.493 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.19 -51.07 77.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.467 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.72 -41.07 96.24 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.888 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.96 92.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.523 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -62.63 -47.76 82.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.992 0.425 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -72.78 -22.18 60.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.126 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.45 25.13 73.48 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 90' ' ' LEU . 38.7 mt . . . . . 0 C--N 1.331 -0.206 0 CA-C-O 120.886 0.374 . . . . 0.0 110.537 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.1 mt . . . . . 0 C--O 1.235 0.322 0 CA-C-O 121.087 0.47 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.404 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 97.6 mt-10 -57.97 -25.96 61.69 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.599 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 70.1 mmtt -61.53 -54.75 39.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.703 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.61 -43.98 79.15 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.572 ' CE3' HD22 ' A' ' 135' ' ' LEU . 13.4 t-105 -58.84 -48.91 79.68 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.478 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.404 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.3 m80 -70.04 -33.38 71.9 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.733 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.534 ' O ' ' OG ' ' A' ' 127' ' ' SER . 11.6 tptt -56.86 -51.27 69.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.718 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.91 -47.28 59.97 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 119.596 -0.841 . . . . 0.0 111.086 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -53.71 -51.48 63.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.918 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.2 m -75.25 -43.27 52.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.73 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 9.6 m -44.48 -30.9 0.95 Allowed 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -160.54 -96.55 0.11 Allowed Glycine 0 CA--C 1.517 0.166 0 C-N-CA 119.48 -1.343 . . . . 0.0 111.526 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.693 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.6 mttt -153.63 21.43 0.53 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -59.14 50.56 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.511 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.693 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.8 p -109.17 135.4 50.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.348 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 96.43 -96.62 1.93 Allowed Glycine 0 CA--C 1.526 0.728 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.908 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.546 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 56.6 mp0 -72.71 -43.79 62.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.342 . . . . 0.0 111.166 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.514 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 46.9 mp0 -63.97 -51.77 62.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.023 0.439 . . . . 0.0 110.404 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.572 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.8 mt -61.56 -39.69 92.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.673 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -60.32 -42.81 96.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.975 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -62.04 -41.4 98.07 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 110.094 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.51 HD13 ' O ' ' A' ' 134' ' ' GLU . 9.4 mp -59.81 -41.81 92.07 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.415 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -66.54 -35.44 80.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 176.687 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -55.31 -43.27 74.7 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.233 178.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.736 ' OE1' HD21 ' A' ' 204' ' ' LEU . 96.5 mt-10 -71.18 -41.19 70.65 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.824 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.415 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 3.6 m-85 -60.46 -54.93 39.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.793 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.02 -39.59 90.33 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.937 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -56.16 -42.68 77.41 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.578 ' CE1' HG23 ' A' ' 197' ' ' ILE . 5.7 m-70 -63.05 -40.78 98.73 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.425 178.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -61.49 -42.93 99.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.884 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.593 ' HA ' ' CE1' ' A' ' 150' ' ' HIS . 98.7 mt-10 -67.97 -46.25 71.9 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 111.555 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -70.83 -43.93 67.55 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.55 -50.62 77.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.725 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -70.08 -23.87 63.14 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.59 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.651 ' HG2' ' CE1' ' A' ' 150' ' ' HIS . 19.8 mm-40 -68.18 -45.0 74.64 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.404 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 16.8 m-85 -62.78 -45.35 93.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -65.5 -41.03 93.66 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.583 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 150' ' ' HIS . 35.2 t -61.94 -46.33 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.0 0.429 . . . . 0.0 110.286 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 81.2 mt . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.513 179.746 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 CA--C 1.521 -0.162 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.502 HD23 ' NZ ' ' A' ' 193' ' ' LYS . 11.4 mt -60.93 -46.86 88.98 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.539 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.555 ' HB3' HH21 ' A' ' 195' ' ' ARG . 56.5 mtpt -74.36 -32.52 62.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 11.2 tm-20 -68.08 -44.81 75.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.364 . . . . 0.0 111.296 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.502 ' NZ ' HD23 ' A' ' 190' ' ' LEU . 17.4 pttt -73.47 -43.91 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.173 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.724 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.83 -40.83 88.12 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.854 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.555 HH21 ' HB3' ' A' ' 191' ' ' LYS . 17.9 ptp180 -67.36 -38.19 84.39 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.447 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.3 p -60.31 -41.15 92.88 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.578 HG23 ' CE1' ' A' ' 145' ' ' HIS . 92.1 mt -64.3 -44.63 97.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.452 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.75 -40.85 98.53 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.961 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.403 ' HA ' ' OD2' ' A' ' 202' ' ' ASP . 89.4 mm-40 -60.4 -41.3 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.688 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.92 -40.15 98.48 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 201' ' ' LEU . 36.2 mt -62.04 -42.86 99.63 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.109 179.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.538 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.4 OUTLIER -64.14 -35.27 80.23 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.474 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.3 tmt_? -60.98 -43.77 98.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.739 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.736 HD21 ' OE1' ' A' ' 141' ' ' GLU . 31.6 mt -62.26 -40.25 95.58 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -64.99 -45.08 87.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.991 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' A' ' 210' ' ' GLN . 82.7 mtp180 -65.21 -44.43 88.36 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.146 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.459 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -68.31 -40.87 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.131 0.491 . . . . 0.0 110.345 -179.459 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 208' ' ' SER . . . . . 0.444 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 68.4 m -60.28 -37.91 81.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.473 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -95.42 -46.66 6.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.636 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 206' ' ' ARG . 54.9 tt0 -81.3 -35.65 30.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.109 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.519 0.297 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.84 ' O ' HG11 ' A' ' 223' ' ' VAL . 2.7 tm-20 . . . . . 0 CA--C 1.502 -0.873 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.507 ' O ' ' CG1' ' A' ' 223' ' ' VAL . 4.2 mp0 61.56 148.19 0.09 OUTLIER Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.226 -177.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.475 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 74.3 Cg_endo -79.3 169.99 18.11 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.396 2.064 . . . . 0.0 111.759 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 89.6 mtm180 69.59 -46.77 0.59 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.517 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 1.018 HG13 ' H ' ' A' ' 224' ' ' ILE . 3.4 p -57.64 -97.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.798 0 CA-C-O 121.458 0.647 . . . . 0.0 111.831 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 1.018 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.3 OUTLIER -42.92 -29.07 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.333 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 225' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 223' ' ' VAL . 98.5 m-20 -62.51 -44.84 95.37 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 223' ' ' VAL . 1.5 mp -59.99 -40.18 88.28 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.557 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 33.3 m0 -59.68 -43.0 94.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.783 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -67.75 -27.26 66.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 2.0 mt -63.08 -46.27 88.18 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.411 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.537 ' O ' ' C ' ' A' ' 231' ' ' GLN . . . -35.54 -67.25 0.16 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.814 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.537 ' C ' ' O ' ' A' ' 230' ' ' ALA . 12.8 tt0 24.62 -103.73 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.937 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.0 p -113.47 27.84 9.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.331 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.86 81.85 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.327 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -175.34 72.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.682 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.61 -169.25 2.3 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.741 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.414 ' OG1' ' OE1' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -110.46 -152.56 0.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.764 -178.902 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -92.53 -59.54 2.05 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.117 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.08 -42.8 99.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 239' ' ' GLU . . . . . 0.414 ' OE1' ' OG1' ' A' ' 236' ' ' THR . 89.2 mt-10 -60.18 -34.0 72.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.602 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.681 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -62.75 -44.4 96.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.292 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -64.89 -47.73 76.74 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.665 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.25 99.2 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.785 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.511 ' O ' ' HG2' ' A' ' 246' ' ' GLU . 1.3 t80 -61.82 -47.58 84.47 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.007 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.25 -42.53 98.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.572 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -59.09 -57.88 11.1 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.396 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 246' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 243' ' ' PHE . 13.3 pt-20 -58.99 -38.87 80.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.948 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 1.9 mm? -61.55 -41.98 98.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.381 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.408 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 65.9 tttm -61.09 -42.23 98.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.157 0.503 . . . . 0.0 109.858 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -65.91 -39.5 90.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.801 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -61.84 -48.49 80.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.562 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 13.7 pt-20 -62.01 -41.87 98.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.079 0.466 . . . . 0.0 110.114 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 252' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -62.83 -38.2 89.82 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.152 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -61.96 -62.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.247 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.13 -37.21 13.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.03 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -65.35 -46.35 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.688 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -62.98 -43.31 99.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -58.07 -43.87 87.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.863 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.11 -40.65 94.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.252 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 259' ' ' HIS . . . . . 0.422 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 83.1 t60 -59.18 -47.61 84.67 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.297 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -62.7 -37.43 86.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.363 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 261' ' ' GLN . . . . . 0.418 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 32.3 mm-40 -57.77 -47.66 81.88 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 120.993 0.425 . . . . 0.0 110.4 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -61.76 -43.24 99.25 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.042 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 263' ' ' GLN . . . . . 0.422 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 4.6 mp0 -60.46 -39.02 86.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.902 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 264' ' ' LEU . . . . . 0.403 HD21 ' HB3' ' A' ' 293' ' ' LEU . 38.0 mt -61.98 -41.84 98.48 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.338 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.92 -48.02 83.75 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-O 121.118 0.485 . . . . 0.0 110.44 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.3 mt -63.03 -43.49 99.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.157 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.12 85.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.27 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.53 -47.73 84.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.222 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -63.31 -45.0 93.37 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.992 0.425 . . . . 0.0 110.676 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -61.33 -42.88 99.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.469 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.668 HD23 ' O ' ' A' ' 271' ' ' LEU . 1.8 tt -60.8 -42.66 98.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.907 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -59.69 -44.07 93.78 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.257 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -71.59 -34.05 69.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.88 0.371 . . . . 0.0 110.509 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.581 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.84 -37.24 86.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.07 -25.36 66.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.871 0.367 . . . . 0.0 110.537 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 67.4 m -87.95 2.72 50.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.874 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.583 HG13 ' N ' ' A' ' 278' ' ' GLY . 11.0 p -60.47 -44.47 96.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.652 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.583 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 156.9 -99.26 0.18 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -61.97 -40.93 97.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 0.0 110.258 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.5 32.81 40.9 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -66.68 -36.8 83.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.836 0.351 . . . . 0.0 110.738 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -77.49 -6.75 54.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.99 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.99 -44.99 99.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.8 t -60.5 -45.32 94.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.149 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.96 -45.84 93.14 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.992 0.425 . . . . 0.0 110.756 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 50.5 m -60.63 -41.9 95.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.182 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -62.23 -40.6 96.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.587 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.02 -57.02 14.93 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.671 ' HD3' HD23 ' A' ' 292' ' ' LEU . 15.0 mmtm -64.62 -35.93 82.6 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.304 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -52.68 -46.99 67.47 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.47 -37.66 80.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.47 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.671 HD23 ' HD3' ' A' ' 289' ' ' LYS . 19.6 tp -61.25 -51.12 70.25 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.712 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 293' ' ' LEU . . . . . 0.403 ' HB3' HD21 ' A' ' 264' ' ' LEU . 10.2 mp -63.56 -41.29 98.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.044 0.45 . . . . 0.0 109.979 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -65.34 -35.04 79.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.077 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.5 -50.07 67.92 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -62.17 -42.74 99.55 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.611 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.418 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 9.4 m -61.28 -48.71 80.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.472 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.33 -41.93 98.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.171 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -62.28 -40.23 95.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.1 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -43.63 98.32 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.128 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.68 98.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.72 -44.61 96.58 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.043 0.449 . . . . 0.0 110.513 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.4 m -60.28 -44.44 95.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.449 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.09 -42.54 90.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.926 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.56 -51.38 70.15 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 110.809 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.67 -43.41 96.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.24 -36.41 83.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.993 0.425 . . . . 0.0 109.981 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.557 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 12.2 mt -60.35 -44.55 95.45 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.138 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 309' ' ' GLN . . . . . 0.403 ' O ' ' OG ' ' A' ' 312' ' ' SER . 96.5 mm-40 -70.91 -57.3 4.72 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.543 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.86 -49.9 75.62 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.676 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 12.9 tp -62.59 -41.63 99.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.508 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 312' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 37.5 p -59.47 -40.59 87.43 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.439 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.93 -41.06 95.6 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -61.74 -44.62 96.55 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.724 -0.28 . . . . 0.0 110.86 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 2.7 mm -65.01 -41.99 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.0 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.6 t -47.65 -42.67 24.99 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 . . . . . 0 C--N 1.327 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.281 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 . . . . . 0 N--CA 1.46 0.049 0 CA-C-O 120.682 0.277 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -62.85 -34.8 78.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.06 147.51 46.01 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.744 0.783 . . . . 0.0 111.222 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -63.57 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.557 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -55.57 -48.61 74.51 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.388 0.613 . . . . 0.0 109.954 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.74 -38.78 91.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.327 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -62.63 -39.03 92.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.573 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.78 -47.28 87.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.511 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.425 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.8 mm? -60.64 -41.85 95.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.048 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.491 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 49.5 t-105 -60.03 -45.23 93.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.282 0.563 . . . . 0.0 110.435 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -56.9 -43.76 81.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.153 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -60.62 -41.72 95.39 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.338 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.95 86.78 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.076 0.465 . . . . 0.0 110.046 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.491 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 76.5 mt-30 -62.6 -37.86 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -60.6 -43.9 96.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.401 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.12 -38.89 92.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.57 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.87 105.66 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.756 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -127.53 154.39 77.51 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.631 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -38.57 155.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.791 2.327 . . . . 0.0 112.144 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.37 -43.25 18.67 Favored 'Trans proline' 0 C--N 1.307 -1.639 0 C-N-CA 122.675 2.25 . . . . 0.0 112.403 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 76.9 t -63.66 -47.16 92.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.472 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -64.08 -41.75 97.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.3 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.68 HD23 ' C ' ' A' ' 42' ' ' LEU . 8.5 tt -61.93 -43.47 98.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.33 -41.54 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.234 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.51 -44.66 74.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.1 tp -62.73 -49.2 75.98 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.961 0.41 . . . . 0.0 110.462 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -59.81 -42.06 92.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.47 -38.93 93.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.606 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -60.34 -52.42 65.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.096 0.474 . . . . 0.0 110.455 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.01 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.253 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.09 -45.73 83.14 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.286 0.565 . . . . 0.0 110.187 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.38 -42.78 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.661 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 tp60 -52.97 -41.83 64.95 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -63.43 -40.74 97.98 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -61.51 -43.58 98.61 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.467 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -60.54 -42.23 96.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.539 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.56 -47.59 79.14 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.323 0.583 . . . . 0.0 109.889 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.54 -39.74 88.99 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.34 0.59 . . . . 0.0 109.811 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.72 87.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.612 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 68.7 t90 -57.21 -39.92 76.42 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -58.42 -46.69 85.98 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.24 -43.52 96.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.308 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -62.19 -40.41 95.97 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.015 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -58.5 -43.62 89.14 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.1 mt . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.775 179.344 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.849 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.55 -37.62 88.03 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.439 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -60.42 -47.11 87.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.067 0.461 . . . . 0.0 110.251 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -59.81 -43.5 94.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.363 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.69 -37.95 86.01 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.522 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.05 -41.69 99.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.89 -43.73 95.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.29 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.22 -44.5 97.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.076 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.616 ' O ' HG23 ' A' ' 83' ' ' VAL . 44.9 ttm180 -59.09 -42.45 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.063 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -62.72 -40.46 97.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.556 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.671 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.41 -48.45 80.61 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.89 -179.574 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -64.9 -38.88 92.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.659 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 79' ' ' ARG . 61.4 t -62.52 -46.4 96.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 94.1 mt -60.49 -48.2 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.066 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' A' ' 85' ' ' LEU . 22.7 mt -65.01 -40.86 95.54 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.068 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.37 -47.35 85.76 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.805 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.14 -47.58 82.14 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.116 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -66.15 -27.22 67.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.448 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 68.27 24.98 74.83 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 90' ' ' LEU . 97.2 mt . . . . . 0 C--N 1.33 -0.254 0 CA-C-O 120.831 0.348 . . . . 0.0 110.827 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.581 ' N ' HD12 ' A' ' 117' ' ' LEU . 7.2 mp . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.942 0.401 . . . . 0.0 110.612 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.421 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 98.5 mt-10 -60.45 -32.65 71.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.642 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.4 mtmt -62.09 -45.91 91.43 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.905 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 47.6 mt -69.02 -46.59 67.58 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.552 ' CE3' HD22 ' A' ' 135' ' ' LEU . 8.4 t-105 -62.95 -44.47 95.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.542 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.421 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.5 m80 -69.47 -38.94 77.95 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.164 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.521 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.0 mptt -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.173 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.464 ' HB1' ' HB2' ' A' ' 130' ' ' PHE . . . -70.26 -45.57 66.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.791 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.482 ' HB2' HD11 ' A' ' 135' ' ' LEU . 65.3 tttm -48.25 -46.08 35.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.136 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 18.2 m -109.65 -60.2 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.643 -0.423 . . . . 0.0 112.005 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.64 -11.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.748 -178.824 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.432 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -134.13 -3.74 3.09 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 56.91 12.75 1.27 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.265 0.555 . . . . 0.0 109.756 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.464 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 6.0 m-30 -68.86 50.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.669 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 5.6 p -96.15 118.15 32.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.731 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 119.93 -97.97 0.69 Allowed Glycine 0 CA--C 1.53 0.979 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.492 178.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -78.85 -43.57 24.81 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.268 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.487 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.0 mp0 -60.67 -47.39 86.48 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.555 -0.458 . . . . 0.0 109.851 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.552 HD22 ' CE3' ' A' ' 121' ' ' TRP . 2.0 mt -62.87 -41.62 99.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.018 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.39 -40.57 94.83 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.999 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.6 -42.27 99.47 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.077 0.465 . . . . 0.0 110.173 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.59 -43.97 93.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.444 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -67.06 -37.7 84.48 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -53.32 -43.93 68.01 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.721 ' OE1' HD21 ' A' ' 204' ' ' LEU . 97.8 mt-10 -71.5 -40.85 69.92 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.669 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.444 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.9 m-85 -59.01 -57.91 10.99 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.568 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 44.3 mt -60.72 -39.06 87.22 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.299 -0.561 . . . . 0.0 110.254 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -51.32 -48.05 62.49 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -63.27 -39.86 95.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.664 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt -61.04 -41.56 96.81 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.318 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -67.68 -53.11 30.36 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 120.77 0.319 . . . . 0.0 111.577 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -61.3 -44.04 97.87 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.808 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.4 t -62.08 -43.86 98.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.747 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.682 ' O ' ' OD1' ' A' ' 153' ' ' ASN . 2.3 m170 -60.14 -41.59 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.56 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -64.79 -37.82 88.9 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.514 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -68.39 -50.67 51.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.131 0.491 . . . . 0.0 111.141 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' ASN . . . . . 0.804 ' OD1' ' N ' ' A' ' 154' ' ' VAL . 56.5 p30 -72.45 -38.43 68.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.865 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.804 ' N ' ' OD1' ' A' ' 153' ' ' ASN . 40.1 t -61.02 -46.45 96.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 155' ' ' LEU . 71.4 mt . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.401 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 . . . . . 0 CA--C 1.519 -0.218 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.554 ' HA ' ' HZ2' ' A' ' 193' ' ' LYS . 9.5 mp -62.12 -42.92 99.71 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.623 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.525 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 23.7 mmtp -67.51 -39.54 85.14 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 83.0 tt0 -67.79 -47.68 68.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.997 0.427 . . . . 0.0 111.66 -179.044 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.554 ' HZ2' ' HA ' ' A' ' 190' ' ' LEU . 1.0 OUTLIER -73.13 -43.12 62.08 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.415 -179.315 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.741 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.94 -42.09 77.21 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.053 -179.648 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.534 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -64.51 -39.25 93.43 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.43 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 49.9 m -60.46 -43.76 96.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.41 -43.23 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.9 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -62.3 -41.53 98.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.847 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -63.6 -38.52 91.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.579 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.87 -48.83 84.13 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.8 mt -62.84 -39.71 95.22 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.129 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.566 ' HB3' HH12 ' A' ' 206' ' ' ARG . 48.8 m-20 -62.31 -37.45 85.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.482 0.658 . . . . 0.0 109.419 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.419 ' C ' ' HD2' ' A' ' 203' ' ' ARG . 4.1 tmm_? -61.66 -41.96 98.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.145 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.721 HD21 ' OE1' ' A' ' 141' ' ' GLU . 21.5 mt -61.14 -39.62 90.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.434 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -60.95 -43.72 98.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.746 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.68 ' O ' ' N ' ' A' ' 210' ' ' GLN . 84.7 mtt85 -64.54 -39.8 94.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.234 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.604 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.1 t -63.62 -45.58 97.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.077 0.465 . . . . 0.0 110.236 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.06 -29.55 64.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.72 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -96.85 -16.75 20.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.274 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.68 ' N ' ' O ' ' A' ' 206' ' ' ARG . 18.8 mm100 -127.66 -37.89 1.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.781 0.324 . . . . 0.0 110.697 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.604 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.539 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.569 ' HB3' HG11 ' A' ' 223' ' ' VAL . 47.6 tp10 . . . . . 0 N--CA 1.448 -0.552 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.666 ' O ' HG12 ' A' ' 223' ' ' VAL . 18.2 tt0 -170.21 131.39 0.95 Allowed Pre-proline 0 CA--C 1.533 0.305 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.778 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.419 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 76.5 Cg_exo -47.17 79.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.668 2.245 . . . . 0.0 112.233 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.564 ' N ' ' O ' ' A' ' 220' ' ' GLU . 0.7 OUTLIER 165.38 -46.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.606 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 1.046 HG13 ' H ' ' A' ' 224' ' ' ILE . 2.1 p -61.48 -84.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.42 0.629 . . . . 0.0 111.228 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 1.046 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.1 mp -52.97 -26.66 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.062 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -63.15 -46.45 87.12 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.326 0.584 . . . . 0.0 109.864 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 17.5 mt -61.76 -40.75 96.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.362 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.437 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 40.8 m0 -61.24 -37.1 81.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.957 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 228' ' ' ASP . . . . . 0.498 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 66.4 t0 -63.48 -37.17 86.28 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' A' ' 230' ' ' ALA . 95.7 mt -64.53 -42.24 95.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.442 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.587 ' O ' ' N ' ' A' ' 233' ' ' ALA . . . -29.97 -70.25 0.06 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.298 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 0.8 OUTLIER -38.0 -47.82 1.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.444 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.443 ' N ' ' O ' ' A' ' 229' ' ' LEU . 6.2 m -86.17 31.88 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.357 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 233' ' ' ALA . . . . . 0.587 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -150.51 111.06 4.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 234' ' ' ASN . . . . . 0.666 ' O ' ' HB2' ' A' ' 235' ' ' LEU . 65.0 t30 48.12 -142.6 0.48 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.228 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' A' ' 234' ' ' ASN . 60.6 mt 85.93 148.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.926 0.766 . . . . 0.0 110.746 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.624 ' H ' ' CD ' ' A' ' 239' ' ' GLU . 0.9 OUTLIER -100.23 -119.86 0.16 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.511 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 237' ' ' ASP . . . . . 0.568 ' N ' ' OE1' ' A' ' 239' ' ' GLU . 32.6 p-10 -122.06 -62.49 1.39 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.864 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.67 -42.16 99.48 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.185 0.517 . . . . 0.0 110.794 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 239' ' ' GLU . . . . . 0.624 ' CD ' ' H ' ' A' ' 236' ' ' THR . 3.2 pm0 -58.5 -29.19 66.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.691 179.22 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.588 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -67.17 -57.89 5.9 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.002 -179.153 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -55.37 -49.45 72.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.515 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.41 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.059 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 1.5 t80 -62.12 -44.86 95.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.238 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 59.4 ttm-85 -57.9 -48.54 79.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.972 0.415 . . . . 0.0 110.355 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.5 -39.27 85.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.628 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -58.9 -55.02 40.57 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.331 0.586 . . . . 0.0 110.344 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.443 ' CD2' ' N ' ' A' ' 247' ' ' LEU . 3.9 mm? -63.91 -34.31 77.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.71 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.7 tttt -57.73 -43.15 85.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 110.265 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -68.57 -43.59 76.25 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.351 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.6 -47.66 82.8 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.504 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.71 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.5 pp20? -60.82 -38.0 83.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.079 0.466 . . . . 0.0 109.756 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.01 -39.07 89.96 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.495 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -63.17 -47.43 82.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.487 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.446 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.3 tt -63.36 -34.83 69.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.072 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.77 -45.44 89.76 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.179 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.02 -43.35 99.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.139 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -43.44 79.41 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.015 0.436 . . . . 0.0 109.976 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -61.02 -41.29 96.27 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.311 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -58.93 -46.28 88.36 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.107 0.479 . . . . 0.0 110.355 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -61.18 -40.84 95.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.119 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 261' ' ' GLN . . . . . 0.436 ' OE1' HG21 ' A' ' 297' ' ' THR . 20.7 mm100 -56.47 -44.15 80.29 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.011 0.434 . . . . 0.0 110.089 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.3 -45.32 94.97 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.059 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -60.06 -38.32 82.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.11 -42.39 99.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.373 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -61.17 -47.55 85.67 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.058 0.456 . . . . 0.0 110.476 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.239 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.68 88.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 29.7 t60 -60.53 -49.21 78.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.357 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -62.7 -44.87 95.13 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.53 -39.8 92.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.566 HD21 ' OE2' ' A' ' 275' ' ' GLU . 4.2 tt -60.72 -45.43 94.26 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.448 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -61.78 -40.23 94.44 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.55 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 12.1 m80 -71.34 -41.39 69.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.914 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -67.97 -41.64 82.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.985 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 275' ' ' GLU . . . . . 0.566 ' OE2' HD21 ' A' ' 271' ' ' LEU . 92.5 mt-10 -56.94 -17.62 10.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.57 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 29.5 m -61.16 -43.99 98.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.628 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.519 HG13 ' N ' ' A' ' 279' ' ' ASP . 2.1 p -66.87 -35.9 75.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.507 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 76.69 37.65 34.0 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 279' ' ' ASP . . . . . 0.519 ' N ' HG13 ' A' ' 277' ' ' VAL . 59.9 t0 -59.79 -44.0 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.845 0.355 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 81.87 -4.12 76.51 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -94.04 -69.9 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.905 0.383 . . . . 0.0 110.375 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -70.77 -20.84 62.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.773 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 58.6 t -62.04 -47.83 91.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.587 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 46.5 t -63.94 -44.53 92.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.047 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.8 -42.31 99.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.649 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 286' ' ' SER . . . . . 0.421 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 39.9 t -62.32 -46.72 87.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.628 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -64.58 -39.55 93.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.949 0.404 . . . . 0.0 110.742 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -58.66 -58.11 10.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.153 0.502 . . . . 0.0 110.167 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.491 ' HD3' HD23 ' A' ' 292' ' ' LEU . 35.2 mmtt -64.47 -31.98 73.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.901 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 290' ' ' HIS . . . . . 0.421 ' HB2' ' O ' ' A' ' 286' ' ' SER . 58.1 t-80 -54.49 -51.34 65.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.865 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.32 82.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.462 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.491 HD23 ' HD3' ' A' ' 289' ' ' LYS . 15.6 tp -62.04 -49.63 75.24 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.779 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.85 -41.67 99.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.941 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.465 ' O ' ' OG1' ' A' ' 297' ' ' THR . 68.8 mm-40 -61.09 -38.06 84.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.078 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.9 -45.22 96.13 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 16.8 tpp85 -61.21 -43.46 98.85 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.693 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 31.5 p -60.22 -43.5 95.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.433 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -63.89 -45.12 90.8 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.449 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.39 -40.78 97.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.267 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -44.08 97.64 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.186 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.8 -41.28 97.55 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -61.35 -46.03 91.94 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.157 0.503 . . . . 0.0 110.719 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 303' ' ' THR . . . . . 0.484 HG22 ' ND1' ' A' ' 307' ' ' HIS . 19.7 m -60.8 -44.38 96.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.56 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -61.08 -43.16 95.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.346 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.22 -49.55 76.66 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.111 0.481 . . . . 0.0 110.803 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -62.13 -44.37 96.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.458 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.484 ' ND1' HG22 ' A' ' 303' ' ' THR . 19.4 m80 -66.82 -31.09 71.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.151 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.552 HD21 HG23 ' A' ' 223' ' ' VAL . 0.5 OUTLIER -60.07 -47.9 83.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.064 -179.6 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.49 -44.14 71.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.808 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -59.68 -51.93 67.67 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.013 0.435 . . . . 0.0 111.089 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 315' ' ' ILE . 36.4 mt -62.57 -48.21 80.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.783 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 8.0 m -69.52 -12.89 62.02 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.693 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -79.57 -64.43 1.9 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 89.5 mmt-85 -68.76 -37.6 79.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.01 0.405 . . . . 0.0 110.972 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 315' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 311' ' ' LEU . 1.2 mm -57.5 -19.88 12.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.748 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 316' ' ' SER . . . . . 0.467 ' C ' ' O ' ' A' ' 315' ' ' ILE . 82.0 p -36.67 -33.8 0.06 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 315' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.53 0.203 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.924 177.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.673 0.273 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.507 HH21 ' CD ' ' A' ' 53' ' ' GLU . 80.4 mtm180 -64.19 -36.61 84.62 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.505 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 30.6 mtp -125.0 147.88 48.73 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.648 0.737 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.772 ' H ' ' CD ' ' A' ' 23' ' ' GLU . 2.0 pm0 -59.15 -32.03 69.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.86 -50.13 73.39 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.31 0.576 . . . . 0.0 110.588 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.8 mp -61.33 -38.74 87.99 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.286 179.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.414 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 55.1 t-20 -63.45 -37.6 87.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.333 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.36 -48.25 82.55 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.297 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.1 mm? -61.06 -42.43 98.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.115 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.567 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 54.6 t-105 -61.81 -43.53 98.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -57.55 -44.25 85.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.207 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -61.42 -41.29 96.93 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.107 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.11 87.2 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.147 0.498 . . . . 0.0 110.129 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.567 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -63.43 -37.68 88.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.075 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -59.91 -44.37 94.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.317 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.36 -39.65 94.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.381 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.46 104.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.798 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.7 mt -121.95 154.3 61.01 Favored Pre-proline 0 C--O 1.233 0.214 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.616 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -40.53 154.11 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.513 2.142 . . . . 0.0 112.377 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.5 -43.67 49.15 Favored 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.521 2.147 . . . . 0.0 112.62 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -48.34 88.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.812 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -66.23 -38.54 88.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.564 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.9 tt -63.63 -43.56 96.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.66 -47.87 76.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.757 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -66.71 -41.81 87.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.614 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.507 HD13 ' OH ' ' A' ' 88' ' ' TYR . 51.4 tp -62.54 -48.57 78.92 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.541 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -60.25 -41.63 93.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.289 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.4 90.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.744 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.409 ' OD1' ' C ' ' A' ' 48' ' ' ASP . 61.3 t0 -60.4 -53.28 59.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.394 . . . . 0.0 110.688 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.86 -39.68 95.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.206 0.527 . . . . 0.0 110.487 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -56.8 -46.79 81.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.133 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.09 -42.49 96.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.679 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -49.57 -45.58 47.9 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.507 ' CD ' HH21 ' A' ' 21' ' ' ARG . 42.1 tp10 -66.99 -36.47 82.24 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.359 -0.537 . . . . 0.0 109.599 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.59 -46.41 89.96 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -64.24 -40.08 95.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.503 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.6 -49.75 74.01 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.983 0.42 . . . . 0.0 110.259 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.82 -42.34 97.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.861 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.78 96.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -57.09 -42.66 81.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.202 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.59 -45.25 94.68 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.72 -45.43 81.89 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.256 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mp -62.36 -42.29 99.28 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.996 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -55.83 -43.99 77.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 41.1 tp . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.757 179.116 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.527 0.833 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -69.29 -36.95 77.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.737 0.303 . . . . 0.0 110.326 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -59.99 -59.58 5.19 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.961 0.41 . . . . 0.0 110.553 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 16.4 pt-20 -57.19 -40.03 76.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.129 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.41 ' N ' ' HG3' ' A' ' 74' ' ' GLU . . . -59.6 -41.31 90.06 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.257 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -63.15 -42.28 99.42 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 77' ' ' LEU . 92.4 mt -63.63 -43.68 96.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.161 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.57 -45.48 97.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.312 0.577 . . . . 0.0 110.06 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.605 ' O ' HG23 ' A' ' 83' ' ' VAL . 42.3 ttm180 -59.46 -43.1 93.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.135 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.417 ' O ' HG13 ' A' ' 84' ' ' ILE . 96.0 m-20 -62.09 -39.68 93.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.374 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.612 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.72 -48.92 79.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.312 0.577 . . . . 0.0 109.874 -179.503 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -64.54 -38.74 92.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 79' ' ' ARG . 70.4 t -63.5 -46.19 95.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.649 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.35 -49.49 83.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.313 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.62 -39.89 88.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.868 0.366 . . . . 0.0 110.788 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -58.36 -50.26 74.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.787 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.92 -43.87 97.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.806 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.507 ' OH ' HD13 ' A' ' 45' ' ' LEU . 4.8 m-85 -62.91 -27.06 69.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.311 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.35 22.64 78.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.8 mt . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.93 0.395 . . . . 0.0 110.612 -179.962 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 80.8 mt . . . . . 0 C--O 1.237 0.407 0 CA-C-O 120.879 0.371 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -54.56 -28.68 47.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.476 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.8 mttt -62.37 -48.14 81.1 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.795 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.53 -44.41 78.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.439 . . . . 0.0 112.013 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.683 ' CE2' HD13 ' A' ' 135' ' ' LEU . 10.3 t-105 -56.54 -53.67 54.83 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.795 -178.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -67.6 -31.8 72.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.49 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.586 ' O ' ' OG ' ' A' ' 127' ' ' SER . 13.8 tptt -57.33 -50.68 72.19 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.052 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.09 -46.84 64.04 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.806 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -50.6 -48.08 57.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.004 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.2 m -85.05 -39.35 18.1 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.586 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 17.0 m -45.75 -30.86 1.76 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.096 -178.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -152.67 -90.17 0.08 OUTLIER Glycine 0 N--CA 1.464 0.541 0 C-N-CA 119.993 -1.099 . . . . 0.0 111.184 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.78 23.3 0.06 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.444 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -67.5 50.48 0.05 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.401 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.476 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.3 m -104.3 118.48 36.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.013 0.435 . . . . 0.0 111.812 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 111.94 -98.04 0.97 Allowed Glycine 0 CA--C 1.53 1.008 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.531 178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.535 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 12.8 pt-20 -73.78 -42.16 61.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.213 0.53 . . . . 0.0 111.149 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.458 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.7 mp0 -59.24 -48.29 82.18 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.258 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.683 HD13 ' CE2' ' A' ' 121' ' ' TRP . 3.0 mt -62.08 -40.48 95.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.127 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.535 ' OD2' ' HA ' ' A' ' 133' ' ' GLU . 0.0 OUTLIER -62.12 -39.31 92.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.075 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -63.1 -43.94 97.08 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 110.02 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.8 mm? -59.95 -42.21 93.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -33.54 76.14 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.69 177.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.589 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 82.0 mmt-85 -58.67 -41.48 86.25 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.67 -40.55 76.34 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.568 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -58.93 -58.45 8.58 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.137 0.494 . . . . 0.0 110.481 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.47 -36.97 77.01 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.049 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.589 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 49.0 m170 -54.17 -42.4 69.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.582 ' O ' HG12 ' A' ' 149' ' ' VAL . 4.6 m-70 -65.98 -36.81 84.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 178.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.85 -45.89 90.99 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.47 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.7 pt-20 -71.42 -47.89 53.05 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.412 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.435 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 49.0 mtmt -63.2 -46.64 86.08 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.178 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.582 HG12 ' O ' ' A' ' 145' ' ' HIS . 6.5 p -62.86 -36.5 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.224 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.696 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.1 OUTLIER -65.33 -40.6 93.88 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.402 179.158 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 155' ' ' LEU . 79.2 mm-40 -64.27 -39.87 94.82 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.534 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.445 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 22.1 m-85 -62.54 -49.13 76.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' ASN . . . . . 0.535 ' OD1' ' HA ' ' A' ' 150' ' ' HIS . 0.9 OUTLIER -74.57 -42.57 58.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.003 0.43 . . . . 0.0 111.004 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 150' ' ' HIS . 70.8 t -61.61 -45.65 98.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.892 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.413 ' CG ' ' O ' ' A' ' 151' ' ' GLU . 77.9 mt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.197 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 . . . . . 0 CA--C 1.52 -0.196 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 3.6 mt -62.15 -46.25 89.82 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.882 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 66.2 mttm -71.73 -40.71 69.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.442 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -68.51 -43.76 76.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.827 -179.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.467 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 22.6 pttt -72.31 -43.81 63.64 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.215 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.812 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.02 -42.9 72.38 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.777 -179.204 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.526 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -66.03 -37.05 84.9 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 57.7 m -59.37 -42.55 91.91 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.41 ' OD1' ' C ' ' A' ' 198' ' ' ASN . 32.8 t-20 -62.54 -42.53 99.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.768 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -64.93 -34.15 77.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.381 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.05 -46.79 92.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.281 -1.127 . . . . 0.0 110.281 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 204' ' ' LEU . 30.2 mt -62.69 -42.26 99.54 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.376 -0.53 . . . . 0.0 109.946 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -62.88 -36.66 84.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.471 ' HD2' ' O ' ' A' ' 203' ' ' ARG . 15.4 tpt180 -64.23 -41.56 96.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.821 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.507 HD12 HD23 ' A' ' 201' ' ' LEU . 81.9 mt -59.25 -38.52 80.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -65.58 -42.15 92.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.623 ' O ' ' N ' ' A' ' 210' ' ' GLN . 79.1 mtt85 -65.74 -36.74 84.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.087 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.651 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.33 -45.99 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.04 0.448 . . . . 0.0 110.127 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 90.0 p -70.25 -27.25 64.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.539 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -98.06 -14.22 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.623 ' N ' ' O ' ' A' ' 206' ' ' ARG . 53.3 tt0 -137.17 -36.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.775 0.322 . . . . 0.0 110.745 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.651 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.521 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 . . . . . 0 C--O 1.233 0.213 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.631 ' O ' ' O ' ' A' ' 221' ' ' PRO . 3.1 tm-20 -59.19 128.91 85.99 Favored Pre-proline 0 C--N 1.329 -0.325 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.236 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.668 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 76.8 Cg_exo -47.09 -155.9 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.611 2.207 . . . . 0.0 111.772 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.668 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 83.5 mtp180 85.81 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.71 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.618 HG13 ' N ' ' A' ' 224' ' ' ILE . 7.5 p -61.07 -51.71 70.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.618 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.6 OUTLIER -64.35 -32.72 58.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.332 0.586 . . . . 0.0 109.516 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -63.25 -39.35 94.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.477 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.522 ' HA ' HD12 ' A' ' 229' ' ' LEU . 10.7 mt -61.29 -40.89 95.83 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.577 ' CH2' HD23 ' A' ' 308' ' ' LEU . 43.6 m0 -59.61 -40.08 86.33 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.029 -0.668 . . . . 0.0 110.057 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 228' ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 49.6 m-20 -63.52 -36.94 85.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.654 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.599 ' C ' ' H ' ' A' ' 231' ' ' GLN . 13.0 mt -63.85 -41.07 97.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.311 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -59.2 4.95 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.974 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.714 ' O ' HD21 ' A' ' 240' ' ' LEU . 5.4 pt20 -64.27 -40.96 97.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.839 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 18.8 p -154.03 23.39 0.5 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.522 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -60.87 -47.63 85.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.677 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -176.9 65.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.55 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 235' ' ' LEU . 94.1 mt -133.42 157.11 46.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.083 0.468 . . . . 0.0 110.675 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 22.0 p -78.95 171.23 15.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.49 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -64.55 -45.25 87.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.996 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.91 -45.61 92.99 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.25 0.548 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -64.64 -33.79 76.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.696 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.714 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -63.04 -42.8 99.83 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.508 -179.94 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 241' ' ' GLU . . . . . 0.582 ' OE2' ' NH2' ' A' ' 244' ' ' ARG . 53.1 tp10 -63.73 -47.72 79.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.197 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.95 -42.75 99.47 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.359 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.587 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.1 OUTLIER -69.87 -30.27 67.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.447 179.406 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 244' ' ' ARG . . . . . 0.582 ' NH2' ' OE2' ' A' ' 241' ' ' GLU . 57.8 ttp180 -65.03 -58.61 5.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.089 0.471 . . . . 0.0 110.691 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -66.32 -39.38 89.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.088 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -57.74 -55.88 29.09 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.304 0.574 . . . . 0.0 110.495 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 247' ' ' LEU . 3.8 mm? -63.77 -33.2 75.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.386 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.641 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.8 tttt -58.75 -42.74 89.57 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.28 0.562 . . . . 0.0 110.272 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 249' ' ' HIS . . . . . 0.407 ' O ' ' HD3' ' A' ' 253' ' ' LYS . 6.4 m-70 -68.89 -43.67 74.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.241 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -61.27 -50.16 74.16 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.433 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.6 pp20? -60.24 -37.13 79.41 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.7 81.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.548 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 253' ' ' LYS . . . . . 0.407 ' HD3' ' O ' ' A' ' 249' ' ' HIS . 13.9 mptt -63.55 -48.64 76.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.36 -38.99 83.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.058 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -59.44 -54.7 43.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.291 0.567 . . . . 0.0 110.434 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -63.43 -40.6 97.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.915 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 257' ' ' HIS . . . . . 0.485 ' NE2' ' O ' ' A' ' 297' ' ' THR . 28.4 t-80 -54.28 -47.2 72.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.12 0.486 . . . . 0.0 109.967 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 258' ' ' ASN . . . . . 0.4 ' O ' ' HB2' ' A' ' 261' ' ' GLN . 60.4 t-20 -61.64 -41.07 96.98 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.174 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -56.34 -45.5 80.36 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 121.098 0.475 . . . . 0.0 109.947 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -63.79 -34.91 78.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.049 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 261' ' ' GLN . . . . . 0.467 ' HG3' ' O ' ' A' ' 257' ' ' HIS . 26.6 mt-30 -58.57 -47.59 83.75 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -61.58 -45.87 92.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.103 0.478 . . . . 0.0 109.754 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -64.85 -33.07 75.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.006 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 47.2 tp -62.36 -43.78 98.01 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.92 0.391 . . . . 0.0 110.268 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -65.91 -46.01 79.84 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.208 0.527 . . . . 0.0 110.444 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.18 -43.63 98.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.311 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.99 86.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.135 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.69 -45.55 93.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -60.08 -48.99 79.43 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.217 0.532 . . . . 0.0 110.65 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -62.15 -39.2 91.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.56 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.635 HD23 ' O ' ' A' ' 271' ' ' LEU . 4.8 tt -60.49 -44.26 96.14 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.965 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 63.0 ttm-85 -60.2 -43.12 96.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.157 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -66.48 -39.84 89.0 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.651 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.35 84.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 275' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 271' ' ' LEU . 96.1 mt-10 -49.64 -19.18 0.55 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.848 0.356 . . . . 0.0 110.396 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 276' ' ' SER . . . . . 0.754 ' O ' ' N ' ' A' ' 278' ' ' GLY . 58.6 m -82.81 -75.89 0.29 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.814 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.506 ' C ' ' O ' ' A' ' 276' ' ' SER . 44.1 t 24.29 -77.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 O-C-N 123.686 0.616 . . . . 0.0 110.831 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.754 ' N ' ' O ' ' A' ' 276' ' ' SER . . . 161.17 -77.67 0.17 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.287 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -86.55 123.05 31.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.883 0.373 . . . . 0.0 110.474 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -67.64 144.1 43.24 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -174.92 -46.42 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -96.1 -6.09 39.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.723 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 67.0 t -62.22 -46.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.512 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.39 -46.19 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.071 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.38 -45.41 94.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.5 t -62.11 -42.82 99.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.635 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -63.22 -40.94 98.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.79 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -60.71 -54.31 46.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.364 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.63 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.8 mmtm -65.09 -33.81 76.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.158 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -57.92 -49.01 78.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.271 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -70.07 -38.22 75.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.747 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.63 HD23 ' HD3' ' A' ' 289' ' ' LYS . 2.7 tp -61.62 -50.24 73.37 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.254 -0.579 . . . . 0.0 110.175 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.55 -41.97 98.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.008 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -62.23 -42.46 99.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.19 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -60.93 -47.77 89.59 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 20.3 tpp85 -61.9 -37.34 84.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.437 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.485 ' O ' ' NE2' ' A' ' 257' ' ' HIS . 3.6 m -59.64 -52.24 66.37 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.399 0.618 . . . . 0.0 110.189 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.14 -39.26 92.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -58.23 -45.64 87.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.294 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -44.11 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.132 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -54.96 -44.29 82.62 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 302' ' ' TYR . . . . . 0.416 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 43.5 t80 -62.49 -43.37 98.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.129 0.49 . . . . 0.0 110.665 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 303' ' ' THR . . . . . 0.627 HG22 ' ND1' ' A' ' 307' ' ' HIS . 17.9 m -59.08 -44.76 91.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.578 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.06 -41.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.202 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -56.52 -57.09 13.83 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-O 121.44 0.638 . . . . 0.0 111.075 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 306' ' ' LYS . . . . . 0.416 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 4.7 mtpt -62.41 -39.94 94.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.723 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.627 ' ND1' HG22 ' A' ' 303' ' ' THR . 4.6 m80 -64.24 -35.7 81.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.106 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.577 HD23 ' CH2' ' A' ' 227' ' ' TRP . 15.4 mt -61.81 -43.93 97.86 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.397 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -67.32 -45.73 75.59 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.998 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.54 -49.67 75.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.963 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.468 ' HA ' HD23 ' A' ' 311' ' ' LEU . 21.9 mt -63.85 -40.63 97.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.856 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 69.4 m -57.7 -43.8 85.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.358 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.49 -43.38 86.94 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 314' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 317' ' ' ARG . 7.0 mpt_? -63.66 -45.64 89.22 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.773 0.321 . . . . 0.0 111.058 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -73.17 -23.35 19.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.126 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 38.4 t -59.18 -43.71 92.18 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 314' ' ' ARG . 10.8 tpp180 . . . . . 0 C--N 1.326 -0.422 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.802 0.334 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -63.74 -39.23 93.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.816 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 93.4 mmm -125.31 153.5 43.18 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.056 0.455 . . . . 0.0 110.875 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -60.75 -37.42 81.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.572 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.6 tttp -58.06 -47.16 83.99 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.261 0.553 . . . . 0.0 110.615 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.05 -39.78 93.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.359 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -64.06 -38.66 91.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.11 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.3 -46.37 88.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.433 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 28' ' ' LEU . 97.0 mt -61.7 -43.19 99.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.094 0.473 . . . . 0.0 109.87 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.597 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 52.6 t-105 -61.62 -43.39 98.94 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.214 0.531 . . . . 0.0 110.233 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -57.66 -42.11 82.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.029 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.58 -41.63 97.7 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.159 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.62 87.46 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.124 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.597 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -62.89 -36.99 85.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.055 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -60.99 -43.14 99.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.337 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -63.56 -39.67 95.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.384 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.81 106.94 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -130.42 154.82 81.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.795 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -37.96 155.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.776 2.317 . . . . 0.0 112.055 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.64 -39.87 11.18 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.546 2.164 . . . . 0.0 112.248 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.28 -48.68 84.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.999 0.428 . . . . 0.0 110.534 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -68.29 -39.54 82.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.711 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -62.9 -44.09 97.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.526 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.65 94.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.274 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -66.87 -46.59 74.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.648 HD12 ' OH ' ' A' ' 88' ' ' TYR . 5.2 tt -63.47 -45.78 89.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.547 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -58.39 -43.34 88.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.107 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 51' ' ' ILE . . . -63.14 -41.71 99.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.642 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -56.55 -51.64 67.81 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.917 0.389 . . . . 0.0 110.734 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.84 -38.57 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.372 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -57.79 -45.07 86.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.201 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 47' ' ' ALA . 2.2 mt -63.5 -42.67 97.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -51.67 -46.19 63.71 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.673 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -64.62 -38.7 91.89 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.908 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -61.52 -44.59 96.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.96 0.409 . . . . 0.0 110.406 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -62.3 -41.57 98.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.377 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -57.3 -49.55 75.73 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.749 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.09 -41.95 93.57 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.967 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.641 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.601 ' HA ' HD21 ' A' ' 62' ' ' LEU . 53.8 t90 -59.1 -41.98 89.41 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.096 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -63.6 -45.16 91.59 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -57.57 -51.57 68.94 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.73 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 59' ' ' TRP . 2.0 pp -65.34 -39.15 92.03 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.808 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 62' ' ' LEU . 29.1 tptp -58.25 -42.28 86.05 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 38.3 tp . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.637 178.65 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.614 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -62.42 -31.44 72.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.696 0.284 . . . . 0.0 110.275 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.89 -52.64 64.54 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.047 0.451 . . . . 0.0 110.271 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -61.14 -42.17 98.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.08 179.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.01 90.58 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.239 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -61.19 -43.14 99.35 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.36 -44.05 97.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.39 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.53 -46.9 91.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 120.97 0.414 . . . . 0.0 110.283 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.715 ' O ' HG23 ' A' ' 83' ' ' VAL . 90.1 mtt-85 -62.88 -42.49 99.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.229 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.417 ' O ' HG13 ' A' ' 84' ' ' ILE . 33.3 t30 -64.01 -39.67 94.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.449 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.64 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.71 -48.55 81.21 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.632 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -64.86 -39.32 93.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.586 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 79' ' ' ARG . 79.4 t -62.84 -45.62 98.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.343 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -61.38 -48.61 88.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.583 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.26 -41.61 94.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.893 0.377 . . . . 0.0 110.542 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.52 89.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.721 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -63.41 -47.95 79.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.596 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.648 ' OH ' HD12 ' A' ' 45' ' ' LEU . 17.9 m-85 -68.87 -30.9 69.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.505 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.48 25.26 36.58 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt . . . . . 0 N--CA 1.462 0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.529 179.664 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 53.7 mt . . . . . 0 C--O 1.237 0.424 0 CA-C-O 121.186 0.517 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.672 ' OE1' ' NE2' ' A' ' 122' ' ' HIS . 27.0 mm-40 -56.04 -25.08 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.194 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 53.4 mttp -61.27 -49.06 78.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.28 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.584 ' O ' HD13 ' A' ' 120' ' ' LEU . 0.2 OUTLIER -69.38 -45.09 70.15 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.998 0.428 . . . . 0.0 111.622 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.652 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.6 t-105 -57.72 -49.72 75.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.324 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.672 ' NE2' ' OE1' ' A' ' 118' ' ' GLU . 12.6 m-70 -66.27 -35.6 80.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.385 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 127' ' ' SER . 14.0 tptt -55.83 -50.89 69.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.819 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.519 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.46 -47.38 64.16 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.105 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -53.98 -51.85 62.59 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.789 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -75.02 -43.91 50.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.005 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.519 ' OG ' ' HA ' ' A' ' 124' ' ' ALA . 22.4 p -46.6 -28.16 1.36 Allowed 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -178.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.49 -95.42 0.11 Allowed Glycine 0 CA--C 1.519 0.314 0 C-N-CA 119.996 -1.097 . . . . 0.0 111.525 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.04 32.23 0.08 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.563 ' CG ' ' OE1' ' A' ' 134' ' ' GLU . 3.9 m-85 -66.81 49.85 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.469 -179.233 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.7 m -104.11 124.11 48.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.008 0.433 . . . . 0.0 111.995 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 109.2 -97.49 1.06 Allowed Glycine 0 CA--C 1.53 0.976 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.384 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 134' ' ' GLU . 15.7 pt-20 -78.62 -43.31 26.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.858 0.361 . . . . 0.0 111.329 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.563 ' OE1' ' CG ' ' A' ' 130' ' ' PHE . 56.7 mt-10 -60.58 -51.35 69.8 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.209 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.652 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.4 mt -63.27 -42.86 99.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.502 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -61.17 -42.0 97.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.624 ' HA ' ' HE ' ' A' ' 140' ' ' ARG . 97.1 mttt -61.88 -41.1 97.48 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.167 0.508 . . . . 0.0 110.002 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.66 -41.73 91.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.445 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -66.19 -34.16 77.4 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 177.429 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.624 ' HE ' ' HA ' ' A' ' 137' ' ' LYS . 53.9 mtm180 -57.56 -45.99 84.47 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.842 -1.143 . . . . 0.0 108.202 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -71.9 -38.1 70.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.938 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -58.88 -58.25 9.45 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.786 -179.289 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.65 -40.73 95.96 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.066 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.581 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 47.6 m170 -56.74 -44.34 81.58 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.726 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 149' ' ' VAL . 3.1 m-70 -60.67 -42.39 96.98 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.606 179.123 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -60.54 -43.48 97.14 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.744 -0.383 . . . . 0.0 111.386 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 151' ' ' GLU . 98.6 mt-10 -65.98 -55.78 15.02 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.703 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.23 -42.68 99.26 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.56 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 145' ' ' HIS . 43.9 t -61.56 -45.42 98.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.144 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.659 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 1.1 p-80 -65.5 -36.27 83.35 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.931 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.602 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 94.2 mt-10 -59.39 -46.23 89.26 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.997 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -61.72 -45.18 95.06 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.684 -0.406 . . . . 0.0 109.955 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -65.65 -39.29 91.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.15 -47.84 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 62.6 mt . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.51 179.147 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 . . . . . 0 CA--C 1.523 -0.08 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 7.6 mt -61.97 -47.54 84.38 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.444 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.493 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.6 mtmt -70.22 -37.73 75.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.939 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -67.67 -51.02 54.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.488 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 18.4 pttt -67.13 -42.9 83.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.313 -179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.712 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -70.06 -40.49 75.05 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.632 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.5 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 25.3 mmt180 -64.06 -39.5 94.22 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.244 -0.583 . . . . 0.0 109.643 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 78.4 p -62.68 -44.3 96.6 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.456 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.97 -44.4 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.91 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -63.37 -41.56 98.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.826 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 32.9 mt-30 -66.03 -29.54 69.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.123 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.59 -47.22 63.37 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 201' ' ' LEU . 32.8 mt -64.44 -42.89 95.72 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.873 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.826 ' OD1' ' O ' ' A' ' 199' ' ' GLN . 0.4 OUTLIER -65.85 -35.38 80.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.0 tmt_? -63.42 -42.93 98.74 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.19 -40.57 96.52 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -62.65 -42.66 99.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.867 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.767 ' O ' ' N ' ' A' ' 210' ' ' GLN . 67.9 mtp180 -65.23 -38.34 90.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.064 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 203' ' ' ARG . 52.9 t -64.07 -47.64 89.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.906 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.8 m -71.16 -29.5 65.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.496 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -93.93 -42.27 9.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.372 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.767 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.7 tt0 -105.04 -35.83 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.11 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.459 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.487 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 219' ' ' GLU . 82.3 tt0 . . . . . 0 CA--C 1.528 0.107 0 CA-C-O 120.708 0.289 . . . . 0.0 110.49 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -56.06 157.47 8.52 Favored Pre-proline 0 C--O 1.232 0.178 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.912 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.484 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 35.3 Cg_exo -56.88 -171.36 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.373 2.049 . . . . 0.0 111.863 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.484 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 0.2 OUTLIER 82.82 -85.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.87 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.998 HG13 ' H ' ' A' ' 224' ' ' ILE . 4.7 p -62.46 -69.22 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.727 0 CA-C-O 121.321 0.581 . . . . 0.0 111.838 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.998 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.5 OUTLIER -56.57 -34.33 41.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 225' ' ' ASP . . . . . 0.425 ' HB2' ' N ' ' A' ' 222' ' ' ARG . 6.4 m-20 -64.42 -37.0 86.0 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.089 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.45 -42.81 96.9 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.491 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 42.7 m0 -61.73 -38.75 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.15 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -61.54 -38.28 86.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 231' ' ' GLN . 92.3 mt -64.7 -42.06 95.55 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.482 0.658 . . . . 0.0 110.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.452 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -45.38 -19.23 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.902 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.447 ' N ' ' O ' ' A' ' 229' ' ' LEU . 66.2 tt0 -75.13 -69.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.628 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.439 ' O ' ' O ' ' A' ' 233' ' ' ALA . 5.0 m -73.3 -19.05 61.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.562 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 233' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -44.04 -96.0 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.668 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -168.87 93.7 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.703 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.452 HD12 ' O ' ' A' ' 230' ' ' ALA . 85.8 mt -141.24 163.83 31.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.649 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.2 p -78.37 166.15 22.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.64 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 237' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 237' ' ' ASP . 60.0 t0 -66.07 -48.74 69.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.154 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -62.13 -46.74 87.66 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.123 0.487 . . . . 0.0 110.451 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -62.19 -40.02 94.65 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.292 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 240' ' ' LEU . 17.3 mt -65.54 -34.2 77.7 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.772 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -63.67 -51.87 63.18 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.084 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -65.36 -41.8 93.43 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.344 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.449 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.7 OUTLIER -66.25 -43.06 87.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.403 179.318 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -58.94 -47.55 84.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.195 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -68.18 -42.6 79.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.703 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -57.03 -51.4 69.4 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.13 0.49 . . . . 0.0 110.43 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 2.3 mm? -63.62 -38.92 92.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.529 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 38.4 ttpt -54.82 -45.04 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -66.14 -40.1 90.34 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.552 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 250' ' ' PHE . . . . . 0.456 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 23.5 t80 -58.07 -50.15 74.44 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.317 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 7.7 pt-20 -62.81 -36.67 83.92 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.86 -38.52 86.51 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.563 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.81 -46.57 87.36 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.243 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -66.08 -39.82 85.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.172 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.19 -46.07 92.0 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.162 0.506 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -61.66 -44.84 96.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.966 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 257' ' ' HIS . . . . . 0.483 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -54.47 -43.02 71.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 258' ' ' ASN . . . . . 0.483 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 47.2 t30 -60.8 -41.25 95.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.305 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -59.99 -48.29 82.32 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.521 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -62.32 -36.22 81.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 261' ' ' GLN . . . . . 0.538 ' OE1' HG21 ' A' ' 297' ' ' THR . 13.1 mm100 -60.58 -42.63 97.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.12 -47.56 85.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.124 0.487 . . . . 0.0 109.86 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -64.06 -35.67 81.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.922 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 62.8 tp -62.04 -41.81 98.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.954 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -63.85 -46.23 85.94 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 110.475 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 67.2 mt -62.74 -43.41 98.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.97 82.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.025 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -61.56 -46.2 90.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -58.09 -48.67 79.45 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.098 0.475 . . . . 0.0 110.119 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -62.46 -35.8 80.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.378 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 271' ' ' LEU . 3.1 tt -59.07 -44.68 91.87 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -63.84 -41.25 97.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.276 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -66.04 -45.04 82.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.659 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.611 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.32 -34.88 77.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.886 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 275' ' ' GLU . . . . . 0.544 ' OE2' HG13 ' A' ' 283' ' ' VAL . 41.6 mm-40 -57.67 -31.42 66.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.893 0.377 . . . . 0.0 110.342 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 5.4 m -87.15 6.79 31.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.926 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 274' ' ' ALA . 12.3 p -60.38 -45.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.759 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.597 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 160.25 -113.0 0.55 Allowed Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -61.32 -47.86 83.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.716 0.294 . . . . 0.0 110.654 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 280' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 135.14 -102.77 0.44 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 65.73 -60.43 0.28 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.931 0.396 . . . . 0.0 110.368 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 282' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -67.1 -17.33 64.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.281 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 283' ' ' VAL . . . . . 0.544 HG13 ' OE2' ' A' ' 275' ' ' GLU . 81.3 t -63.81 -43.3 97.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.803 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 284' ' ' SER . . . . . 0.46 ' O ' ' HG2' ' A' ' 287' ' ' ARG . 5.8 t -59.22 -45.72 90.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.156 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -69.63 -43.85 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 286' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 4.4 p -61.27 -48.6 80.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.932 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 287' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 284' ' ' SER . 34.9 ptt180 -65.58 -34.88 79.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 110.467 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.24 -65.1 0.7 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.092 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.486 ' HD3' HD23 ' A' ' 292' ' ' LEU . 25.6 mmtt -63.04 -39.21 94.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.824 -0.75 . . . . 0.0 109.961 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 290' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 286' ' ' SER . 39.7 t-80 -43.94 -55.78 4.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.076 0.465 . . . . 0.0 110.051 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.24 79.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.883 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.486 HD23 ' HD3' ' A' ' 289' ' ' LYS . 18.1 tp -59.78 -53.21 60.63 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.838 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.21 -42.26 96.68 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.253 0.549 . . . . 0.0 110.31 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.0 tt0 -61.93 -37.68 85.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.786 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.48 -43.67 97.83 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -59.45 -44.44 92.97 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.356 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.538 HG21 ' OE1' ' A' ' 261' ' ' GLN . 44.8 p -59.17 -44.61 92.16 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.654 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -62.36 -45.32 93.7 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.638 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.79 -38.88 89.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.202 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.26 96.71 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.35 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.69 -42.71 98.04 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -61.3 -44.23 97.56 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.995 0.426 . . . . 0.0 110.573 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 303' ' ' THR . . . . . 0.578 HG22 ' ND1' ' A' ' 307' ' ' HIS . 19.8 m -60.44 -43.92 96.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.656 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.83 -43.38 91.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -57.8 -51.78 68.19 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.824 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -63.61 -40.92 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.462 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.578 ' ND1' HG22 ' A' ' 303' ' ' THR . 5.8 m80 -63.62 -36.42 83.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.929 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.528 ' CD2' HG21 ' A' ' 223' ' ' VAL . 7.8 mt -62.02 -44.38 96.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.614 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.4 -47.81 69.22 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.943 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.46 -48.14 82.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 311' ' ' LEU . 25.5 mt -63.2 -39.45 94.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.576 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.2 t -58.93 -44.42 91.37 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.15 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.63 -41.75 89.1 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 314' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 317' ' ' ARG . 94.3 mtt-85 -64.41 -45.13 88.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.917 0.389 . . . . 0.0 111.233 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.9 mm -72.52 -18.03 18.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.712 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 71.8 p -50.49 -34.82 26.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 314' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 178.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.802 0.334 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.439 ' HE ' ' HG3' ' A' ' 53' ' ' GLU . 52.5 ptt85 -91.29 -6.4 53.22 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.548 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.408 ' SD ' ' NZ ' ' A' ' 24' ' ' LYS . 3.6 mmt -137.45 144.46 42.33 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.767 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.692 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 46.6 tp10 -66.13 -53.12 41.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.465 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.408 ' NZ ' ' SD ' ' A' ' 22' ' ' MET . 8.0 pttm -51.58 -43.74 62.55 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.239 0.542 . . . . 0.0 110.322 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.2 tp -61.62 -42.95 99.61 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.386 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.723 ' OD1' ' N ' ' A' ' 27' ' ' GLN . 1.5 p-10 -65.25 -25.35 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.234 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.723 ' N ' ' OD1' ' A' ' 26' ' ' ASN . 92.2 mt-30 -69.47 -45.62 68.58 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.921 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HA ' HD13 ' A' ' 28' ' ' LEU . 4.3 mm? -61.83 -41.68 98.09 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.387 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.495 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 41.2 t-105 -61.82 -46.04 91.22 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.342 0.592 . . . . 0.0 110.399 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -57.86 -41.31 82.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.182 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -60.91 -41.76 96.75 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.183 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.93 86.85 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.205 0.526 . . . . 0.0 110.415 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.495 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 75.0 mt-30 -58.29 -39.12 78.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.241 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -62.78 -41.54 99.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.511 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.13 -34.84 77.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.262 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.57 107.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.869 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 37' ' ' LEU . 86.2 mt -129.05 154.54 80.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.572 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 74.8 Cg_exo -41.63 153.32 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.529 2.153 . . . . 0.0 112.206 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.6 Cg_exo -57.2 -47.31 23.14 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.724 2.283 . . . . 0.0 112.327 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 69.5 t -64.29 -47.19 90.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.667 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -63.2 -41.87 99.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.389 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.0 tt -62.3 -43.01 99.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.629 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.5 -41.2 96.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.453 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -69.92 -42.54 73.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.496 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.97 -48.88 78.37 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -61.84 -40.54 95.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.21 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.43 -47.0 87.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.6 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.971 ' O ' HG22 ' A' ' 51' ' ' ILE . 50.3 t0 -59.43 -49.84 76.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.119 0.485 . . . . 0.0 110.293 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.63 -41.4 99.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.1 0.476 . . . . 0.0 110.441 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.26 -47.45 85.95 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.35 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.971 HG22 ' O ' ' A' ' 48' ' ' ASP . 16.9 tt -59.51 -36.82 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.403 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 52.2 tt0 -60.96 -42.42 98.26 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.439 ' HG3' ' HE ' ' A' ' 21' ' ' ARG . 76.7 tt0 -61.07 -40.29 93.09 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.85 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -62.92 -44.29 96.48 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.728 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -60.98 -41.28 96.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.485 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -57.78 -48.49 79.54 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.005 0.431 . . . . 0.0 110.186 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.3 tp -59.99 -41.43 92.02 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.11 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.13 93.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.299 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.6 t90 -58.34 -44.97 88.95 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.067 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.58 -46.22 91.04 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.54 -41.87 86.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.181 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.12 -40.04 96.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.962 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.72 -42.98 84.91 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 39.4 mt . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.103 179.123 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -58.95 -36.18 74.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.359 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 73' ' ' LYS . 13.6 mptt -56.65 -68.58 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.099 0.476 . . . . 0.0 109.958 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -46.04 -38.95 8.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.16 94.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.559 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.411 ' O ' ' ND2' ' A' ' 80' ' ' ASN . 77.8 mtp85 -63.64 -38.96 93.09 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.448 ' N ' HD12 ' A' ' 77' ' ' LEU . 9.3 mp -64.32 -45.07 89.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.11 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.07 -45.91 95.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.177 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.741 ' O ' HG23 ' A' ' 83' ' ' VAL . 77.2 ttt-85 -59.57 -43.85 93.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.112 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.411 ' ND2' ' O ' ' A' ' 76' ' ' ARG . 43.5 m-80 -62.63 -39.74 94.78 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.112 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.666 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.22 -50.92 71.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.285 0.564 . . . . 0.0 110.239 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.409 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 30.0 t-20 -64.97 -37.32 87.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.699 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 79' ' ' ARG . 73.2 t -63.27 -45.88 97.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.393 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.16 -49.98 82.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.507 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.449 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.6 mm? -66.55 -42.02 87.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.019 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.24 94.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.06 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -62.38 -47.9 82.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.855 -179.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.08 -26.6 68.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.265 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.19 8.12 78.95 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.969 -0.853 . . . . 0.0 110.969 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 90' ' ' LEU . 56.5 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-O 120.827 0.346 . . . . 0.0 110.557 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 C--O 1.239 0.501 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.43 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 94.7 mt-10 -62.4 -28.69 69.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.505 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 11.2 mmmt -60.96 -46.62 90.0 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.574 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 120' ' ' LEU . 81.3 mt -69.35 -46.79 66.17 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 120.948 0.404 . . . . 0.0 111.796 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.45 ' CE3' HD22 ' A' ' 135' ' ' LEU . 11.9 t-105 -59.25 -47.08 86.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.605 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.43 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.3 m80 -69.73 -34.22 73.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.615 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.541 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 10.6 tptt -57.92 -52.0 67.32 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.178 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.818 ' O ' ' O ' ' A' ' 128' ' ' GLY . . . -73.61 -46.7 45.44 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.523 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.573 ' HB2' HD11 ' A' ' 135' ' ' LEU . 64.3 tttm -50.09 -39.79 43.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.669 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.463 ' C ' ' H ' ' A' ' 128' ' ' GLY . 20.8 m -97.69 -66.67 0.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.708 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 m -55.74 -7.0 0.24 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.419 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 1.153 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -160.25 98.38 0.17 Allowed Glycine 0 C--O 1.226 -0.373 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -41.98 44.78 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.355 0.598 . . . . 0.0 109.928 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 1.153 ' N ' ' O ' ' A' ' 128' ' ' GLY . 3.4 m-30 -81.05 32.09 0.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.385 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.647 ' HA ' HD12 ' A' ' 135' ' ' LEU . 6.2 m -85.13 128.45 34.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.008 0.432 . . . . 0.0 111.533 -179.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.45 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . 111.3 -98.17 1.01 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.356 177.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 74.7 mm-40 -79.17 -43.85 23.11 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.991 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.463 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.1 mp0 -62.44 -50.49 71.28 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.076 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.647 HD12 ' HA ' ' A' ' 131' ' ' SER . 2.7 mt -61.09 -42.09 97.87 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.363 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.45 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 96.2 m-20 -63.3 -37.71 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.936 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 23.1 mmtp -62.26 -44.25 96.97 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-O 121.266 0.555 . . . . 0.0 109.991 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.2 mm? -60.21 -43.47 95.93 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.247 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.481 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -65.21 -36.64 84.79 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.058 176.459 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.607 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 86.5 mtt180 -53.53 -43.79 68.66 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -70.12 -38.37 75.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.76 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.481 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.1 m-85 -59.35 -58.54 8.16 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.59 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 67.0 mt -60.79 -38.84 86.7 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.022 -0.671 . . . . 0.0 110.26 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.607 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 61.3 m170 -53.15 -43.98 67.45 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.096 -0.642 . . . . 0.0 109.706 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.461 ' ND1' HG23 ' A' ' 197' ' ' ILE . 3.3 m-70 -64.09 -39.52 94.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.658 178.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -61.75 -44.46 96.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.33 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -68.26 -51.2 47.79 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.698 0.285 . . . . 0.0 111.516 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -61.58 -43.42 98.9 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.954 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 26.1 t -62.49 -43.36 98.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.021 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.771 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -63.21 -38.51 91.45 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.67 -47.68 84.26 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.279 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.46 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 23.0 m-85 -65.8 -46.62 77.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.551 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -67.52 -43.82 79.89 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.504 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.771 HG23 ' O ' ' A' ' 150' ' ' HIS . 77.9 t -63.31 -45.48 98.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.031 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.2 mt . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.519 179.767 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 . . . . . 0 C--O 1.232 0.168 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.626 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 7.1 mt -62.47 -43.35 99.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.866 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.6 mttm -70.67 -32.72 70.08 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.602 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.4 tt0 -68.42 -45.89 71.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.183 -178.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.626 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 7.8 ptmt -73.47 -44.61 57.62 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.498 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.78 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -65.18 -41.72 94.34 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.887 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.529 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -68.32 -36.58 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.819 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.412 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 63.8 m -61.45 -40.93 96.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.461 HG23 ' ND1' ' A' ' 145' ' ' HIS . 96.6 mt -63.53 -43.95 98.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.518 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.8 -42.25 97.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -63.97 -37.39 87.24 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.568 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.98 -43.15 99.79 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 17.5 mt -64.06 -42.26 97.06 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.201 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.69 -38.38 90.19 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.778 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.665 ' O ' HG12 ' A' ' 207' ' ' VAL . 31.7 mt -61.0 -39.01 88.07 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.413 179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 83.3 mtt-85 -64.12 -41.62 97.16 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.19 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.6 mtp180 -64.82 -42.85 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.769 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.665 HG12 ' O ' ' A' ' 204' ' ' LEU . 0.3 OUTLIER -63.77 -37.42 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.44 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 208' ' ' SER . . . . . 0.417 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 25.4 m -75.96 -26.92 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.575 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -98.29 -15.08 19.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.033 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.526 ' N ' ' O ' ' A' ' 206' ' ' ARG . 52.4 mt-30 -129.53 -39.07 1.5 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.696 -179.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.549 0 N-CA-C 111.392 -0.683 . . . . 0.0 111.392 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 . . . . . 0 N--CA 1.441 -0.889 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -145.18 154.5 54.14 Favored Pre-proline 0 C--N 1.326 -0.431 0 C-N-CA 119.165 -1.014 . . . . 0.0 110.479 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.73 13.99 0.88 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.663 2.242 . . . . 0.0 112.147 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -124.58 -40.98 2.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.02 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 1.068 HG13 ' H ' ' A' ' 224' ' ' ILE . 5.8 p -61.47 -78.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.246 0.916 0 CA-C-O 121.42 0.629 . . . . 0.0 110.869 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 1.068 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.1 mp -58.05 -25.54 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.45 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -63.24 -46.91 84.71 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.205 0.526 . . . . 0.0 109.844 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.457 HD23 HD12 ' A' ' 229' ' ' LEU . 24.5 mt -61.48 -40.99 96.53 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.677 179.119 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.0 m0 -61.39 -35.58 77.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.953 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -64.86 -37.28 87.1 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.708 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.6 mt -63.41 -41.27 98.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.968 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -60.03 20.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.0 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.708 ' H ' ' C ' ' A' ' 229' ' ' LEU . 13.8 tt0 -94.26 -44.82 7.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.668 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.2 p -121.03 -0.69 9.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.622 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.33 -103.52 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.587 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -141.53 95.39 2.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.505 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 3.8 mp -137.84 160.26 39.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.95 0.405 . . . . 0.0 110.562 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 33.9 p -85.44 -157.41 0.32 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.586 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 237' ' ' ASP . . . . . 0.47 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 27.4 p-10 -96.34 -59.33 1.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.629 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 238' ' ' LYS . . . . . 0.47 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 54.4 mtmt -62.25 -44.03 97.48 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 110.697 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -60.33 -32.0 70.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.163 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.632 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -63.94 -43.24 96.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.189 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -63.73 -49.5 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.16 -38.23 85.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.042 0.449 . . . . 0.0 110.092 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.578 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.3 OUTLIER -68.21 -41.74 80.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.01 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -58.6 -52.25 66.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.96 0.41 . . . . 0.0 110.197 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.7 -42.27 95.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.577 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -56.5 -48.12 77.86 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.416 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 243' ' ' PHE . 1.4 mm? -63.49 -38.38 90.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.484 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.797 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 78.7 tttt -56.56 -44.81 81.29 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.347 0.594 . . . . 0.0 110.296 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -67.62 -38.57 84.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.488 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.35 -49.24 78.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.797 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.1 OUTLIER -60.5 -39.89 89.4 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.237 0.542 . . . . 0.0 109.873 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 252' ' ' ALA . . . . . 0.521 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.08 -36.86 84.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.266 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -62.37 -49.88 73.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.144 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.485 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.9 tt -61.91 -36.0 71.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.362 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -62.98 -45.9 90.26 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.166 0.508 . . . . 0.0 110.349 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -63.16 -44.77 94.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.536 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 257' ' ' HIS . . . . . 0.793 ' HB2' HD23 ' A' ' 300' ' ' LEU . 2.3 t-80 -55.96 -43.49 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.163 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -62.07 -40.97 97.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.19 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 259' ' ' HIS . . . . . 0.519 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 80.2 t60 -58.76 -48.21 82.02 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.413 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -63.52 -33.44 75.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.544 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -61.63 -47.71 84.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.214 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -61.43 -46.25 90.87 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.051 0.453 . . . . 0.0 110.061 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 263' ' ' GLN . . . . . 0.519 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.6 mp0 -64.7 -35.18 80.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.242 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.82 -42.59 99.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.06 -46.24 85.23 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.467 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.64 -43.37 98.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.346 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -63.26 -36.89 85.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.252 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -61.64 -47.73 84.05 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.332 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -64.54 -43.52 93.7 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.628 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.49 -43.09 99.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.518 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.573 HD23 ' O ' ' A' ' 271' ' ' LEU . 6.1 tt -60.85 -44.38 97.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.322 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.97 -43.9 91.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.281 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -69.07 -47.32 65.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.663 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.841 ' O ' HG22 ' A' ' 277' ' ' VAL . . . -60.43 -24.63 65.34 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.492 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -84.46 -1.74 56.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.476 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 42.2 m -120.06 -3.14 10.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.707 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.841 HG22 ' O ' ' A' ' 274' ' ' ALA . 16.8 m -63.33 -42.66 97.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.499 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.448 ' N ' HG23 ' A' ' 277' ' ' VAL . . . 139.03 -82.9 0.25 Allowed Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.88 139.06 58.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.757 0.313 . . . . 0.0 110.402 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -107.41 116.44 4.92 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -145.49 -45.12 0.21 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.488 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -98.7 0.64 45.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.553 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.97 -48.29 88.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.538 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.5 t -63.36 -46.84 84.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.907 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.6 -41.65 96.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.739 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.0 t -62.47 -44.07 97.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -63.43 -41.61 98.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.498 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -60.34 -52.33 65.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.278 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.534 ' HD3' HD23 ' A' ' 292' ' ' LEU . 18.2 mmtm -65.77 -33.42 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.135 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -56.45 -48.05 77.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.155 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.22 -40.44 71.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.968 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.591 ' O ' HD12 ' A' ' 292' ' ' LEU . 3.5 tp -61.81 -50.67 71.39 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.26 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 23.9 tp -63.63 -41.48 98.25 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.4 tt0 -62.73 -37.72 87.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.022 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 295' ' ' GLY . . . . . 0.463 ' O ' ' HG3' ' A' ' 299' ' ' GLU . . . -64.01 -47.03 89.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 296' ' ' ARG . . . . . 0.461 HH12 HD22 ' A' ' 300' ' ' LEU . 15.4 tpt85 -57.82 -44.16 86.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.474 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 12.2 p -60.36 -48.1 83.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.346 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 299' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 295' ' ' GLY . 90.3 mt-10 -57.95 -55.33 36.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.592 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 300' ' ' LEU . . . . . 0.793 HD23 ' HB2' ' A' ' 257' ' ' HIS . 12.9 tp -61.56 -45.03 95.87 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.465 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -47.43 -47.02 22.88 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.084 -1.206 . . . . 0.0 110.084 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -65.48 -37.15 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.929 0.395 . . . . 0.0 109.967 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 20.0 m -60.47 -47.4 86.29 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 304' ' ' VAL . . . . . 0.401 HG13 HD13 ' A' ' 308' ' ' LEU . 1.3 t -61.36 -46.13 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.376 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.41 -46.78 88.69 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.044 0.449 . . . . 0.0 110.284 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -58.56 -50.18 74.72 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.424 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.55 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.4 OUTLIER -65.07 -30.34 71.29 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.99 178.536 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.782 HD11 HG21 ' A' ' 223' ' ' VAL . 1.4 tp -58.53 -46.58 86.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.056 -178.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -76.15 -54.49 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.813 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 310' ' ' ASP . . . . . 0.415 ' C ' ' OD1' ' A' ' 310' ' ' ASP . 61.6 t0 -58.96 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.55 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 3.4 tp -61.67 -39.79 92.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.512 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 312' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 10.4 t -58.73 -43.56 90.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.665 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.17 -40.12 94.8 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 314' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 317' ' ' ARG . 77.5 mtp180 -61.7 -43.46 98.82 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-O 120.693 0.282 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.7 -42.48 95.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.792 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 83.6 p -49.67 -39.77 37.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.224 0.535 . . . . 0.0 109.649 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 314' ' ' ARG . 22.4 tpp85 . . . . . 0 CA--C 1.513 -0.465 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.643 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 C--O 1.235 0.3 0 CA-C-O 120.669 0.271 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -88.68 2.39 53.37 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.723 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 3.7 mmt -143.11 140.06 30.71 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.375 0.607 . . . . 0.0 110.824 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.22 -36.26 81.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.306 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -56.5 -47.08 80.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.131 0.491 . . . . 0.0 110.542 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 25' ' ' LEU . 99.3 mt -61.47 -40.17 93.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.856 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -63.94 -37.4 87.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.169 179.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -60.39 -48.66 80.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.297 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.429 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 4.0 mm? -61.23 -42.38 98.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.205 179.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.509 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 34.1 t-105 -62.18 -44.53 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.229 0.538 . . . . 0.0 110.387 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -57.03 -44.96 83.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.246 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.6 -42.82 97.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.424 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.27 -41.85 80.5 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.218 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.509 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.2 mt-30 -64.7 -37.67 88.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.192 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -60.09 -43.62 95.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.449 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.39 -39.46 92.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.596 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.45 110.72 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.849 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.47 HD22 ' HE ' ' A' ' 41' ' ' ARG . 13.8 mt -131.46 154.16 81.81 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.62 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -43.28 154.32 0.18 Allowed 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.618 2.212 . . . . 0.0 112.193 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.51 -42.04 69.74 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.582 2.188 . . . . 0.0 112.191 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.15 -49.71 82.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.551 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.47 ' HE ' HD22 ' A' ' 37' ' ' LEU . 78.6 mtp85 -66.47 -41.35 89.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 tp -64.26 -40.18 95.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.434 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 41' ' ' ARG . 18.1 pt-20 -65.15 -38.86 91.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.466 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.37 -50.11 72.85 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.398 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.3 t60 -61.2 -39.97 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.444 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.94 92.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.425 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -60.56 -50.17 74.61 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.366 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.04 -39.3 94.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.383 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -56.55 -46.91 80.43 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.215 0.531 . . . . 0.0 110.142 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.7 mt -62.31 -42.73 96.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.761 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -51.51 -42.81 61.98 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -64.42 -41.26 96.7 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -61.4 -44.45 97.13 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.629 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -61.22 -41.62 97.17 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.373 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -54.75 -46.74 74.37 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.149 0.499 . . . . 0.0 110.062 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 23.8 mt -61.72 -41.4 97.57 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.334 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.94 -46.33 88.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.647 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.5 t90 -58.99 -39.9 83.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.342 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -59.89 -46.06 90.53 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.08 -41.51 92.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.114 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.36 -40.5 94.51 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.956 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.37 -43.3 96.69 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 51.5 tp . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.889 179.714 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.753 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -56.94 -36.63 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.863 0.363 . . . . 0.0 110.32 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -58.86 -64.78 0.81 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.853 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -44.87 -42.73 8.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.209 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.11 84.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.214 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -62.04 -41.58 98.27 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.495 ' N ' HD12 ' A' ' 77' ' ' LEU . 10.7 mp -62.86 -43.65 98.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.957 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.36 -47.72 90.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.106 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.681 ' O ' HG23 ' A' ' 83' ' ' VAL . 93.7 mtt-85 -59.51 -43.35 93.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.924 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.501 ' O ' HG13 ' A' ' 84' ' ' ILE . 93.2 m-20 -64.33 -41.26 96.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.389 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.3 -48.33 71.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.008 0.432 . . . . 0.0 110.253 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -66.77 -36.48 82.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.366 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 79' ' ' ARG . 75.1 t -63.85 -47.95 88.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.539 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 80' ' ' ASN . 48.6 mt -61.26 -50.34 80.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.631 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.22 -41.79 94.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.918 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.68 80.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.72 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.29 -44.77 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.844 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -59.47 -34.27 72.35 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.098 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 88.79 17.76 55.86 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--O 1.223 -0.322 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.412 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 N--CA 1.461 0.094 0 CA-C-O 120.836 0.35 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -58.5 -33.35 69.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.811 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.76 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 52.7 mtpt -61.09 -48.35 82.11 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.901 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.575 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 13.5 mt -70.57 -46.83 62.75 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.966 0.412 . . . . 0.0 111.939 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.673 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.8 t-105 -59.38 -49.54 77.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.456 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -71.16 -32.85 69.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.661 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.76 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 11.6 tptt -55.43 -51.65 66.19 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.949 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.09 -46.79 49.42 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.885 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.412 ' HB2' HD11 ' A' ' 135' ' ' LEU . 58.4 tttm -50.97 -48.75 61.03 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.969 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 12.4 m -83.91 -41.15 17.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.872 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.597 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 8.8 t -46.48 -26.1 0.8 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.296 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -159.09 -94.51 0.1 Allowed Glycine 0 N--CA 1.464 0.536 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.363 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.548 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.2 pttp -161.52 24.08 0.12 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.96 44.74 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.318 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.1 p -103.44 136.42 43.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.083 0.468 . . . . 0.0 111.288 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 97.89 -97.1 1.89 Allowed Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.173 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 94.7 mt-10 -75.11 -43.81 50.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.806 0.336 . . . . 0.0 111.116 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.62 ' O ' HD23 ' A' ' 138' ' ' LEU . 53.3 mp0 -61.82 -54.38 43.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.673 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.8 mt -59.63 -40.51 87.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.323 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -60.77 -44.11 97.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 61.3 mttp -60.55 -44.17 96.42 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.665 HD13 ' OE2' ' A' ' 141' ' ' GLU . 4.5 mm? -57.79 -39.11 76.76 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.607 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -73.28 -29.43 62.73 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.344 -0.843 . . . . 0.0 113.08 177.174 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.512 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 95.3 mtt-85 -57.38 -46.49 83.36 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.097 -1.041 . . . . 0.0 108.243 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.665 ' OE2' HD13 ' A' ' 138' ' ' LEU . 6.1 pt-20 -72.71 -37.65 67.73 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.733 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.607 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.9 m-85 -55.75 -57.26 12.76 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.393 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.787 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 48.6 mt -61.75 -39.22 90.84 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.043 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.512 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 63.4 m170 -54.54 -41.02 69.25 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.758 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -65.28 -45.88 82.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.193 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.787 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 45.4 pttt -59.65 -44.43 93.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.175 -178.116 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.545 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 74.1 mm-40 -68.24 -48.88 63.94 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.542 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -60.99 -44.21 97.74 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.856 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.84 -45.36 99.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.112 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.702 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.3 m170 -64.59 -34.29 77.91 Favored 'General case' 0 C--O 1.216 -0.699 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.362 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -64.65 -48.04 76.27 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.229 -0.589 . . . . 0.0 110.502 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.424 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 37.2 m-85 -63.95 -46.37 85.01 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.566 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -69.1 -45.18 70.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.837 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 150' ' ' HIS . 71.2 t -64.79 -43.73 96.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.342 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 C--O 1.238 0.5 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.373 -179.13 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 . . . . . 0 C--O 1.238 0.493 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.467 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 8.8 mp -61.78 -38.55 88.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.225 178.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 195' ' ' ARG . 97.9 mttt -67.67 -32.48 73.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.388 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 97.3 mt-10 -67.85 -50.12 58.33 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.023 0.44 . . . . 0.0 111.386 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.469 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 ptmt -71.55 -41.76 68.71 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.373 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.778 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.29 -41.72 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.841 -179.361 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.559 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 14.6 ptm180 -63.46 -39.13 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.7 -41.72 97.98 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 193' ' ' LYS . 85.2 mt -64.2 -43.32 97.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.561 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.475 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.5 m-20 -62.59 -40.86 98.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.247 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.524 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 1.3 mp0 -60.55 -39.17 86.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -62.94 -37.96 95.79 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 201' ' ' LEU . 21.6 mt -63.19 -41.12 99.15 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.717 178.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.543 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.5 OUTLIER -64.2 -35.97 82.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.482 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.5 tmt_? -64.25 -41.15 97.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.915 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.9 mt -61.58 -40.25 94.07 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -61.69 -42.86 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.897 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.577 ' O ' ' HG2' ' A' ' 210' ' ' GLN . 73.5 mtp85 -62.7 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.676 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -62.55 -36.6 75.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 75.4 p -77.37 -26.08 51.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.094 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -95.05 -12.98 25.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.884 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.577 ' HG2' ' O ' ' A' ' 206' ' ' ARG . 12.3 pt20 -131.82 -37.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.303 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.629 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.527 0.825 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 120.641 0.258 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -45.91 161.54 0.26 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.88 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -71.29 111.13 3.02 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.527 2.151 . . . . 0.0 112.45 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -170.32 -84.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.845 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.618 HG23 ' N ' ' A' ' 224' ' ' ILE . 2.7 m -61.87 -49.74 83.01 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 CA-C-O 121.506 0.67 . . . . 0.0 110.575 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.618 ' N ' HG23 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -67.25 -26.51 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -66.99 -42.48 84.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.417 0.627 . . . . 0.0 109.318 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.0 tp -61.08 -42.05 97.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.171 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.449 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 48.2 m0 -60.62 -37.76 82.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.848 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -60.7 -39.47 88.66 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 229' ' ' LEU . 92.8 mt -62.44 -42.25 99.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.947 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 227' ' ' TRP . . . -41.19 -32.44 0.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.855 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -68.95 -67.83 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.657 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 91.0 p -66.23 -18.87 65.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.495 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.25 -106.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.653 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -155.83 105.03 2.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.536 HD22 ' OE2' ' A' ' 239' ' ' GLU . 70.9 mt -146.68 168.59 20.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.715 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 69.4 p -80.12 164.43 23.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -63.39 -49.4 73.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.99 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.18 -44.84 94.29 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.566 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 239' ' ' GLU . . . . . 0.536 ' OE2' HD22 ' A' ' 235' ' ' LEU . 81.6 tt0 -62.95 -36.18 82.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.027 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.749 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.33 -44.05 96.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.985 0.422 . . . . 0.0 110.44 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.64 -55.02 30.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.506 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.36 77.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.065 0.46 . . . . 0.0 110.402 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.418 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.04 -43.8 98.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.283 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -54.14 -54.21 42.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.045 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -62.54 -39.08 92.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.282 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -56.86 -51.96 67.01 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.233 0.54 . . . . 0.0 110.45 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.2 mm? -63.42 -36.86 85.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.772 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.439 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 88.7 tttt -55.94 -48.46 75.7 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.303 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 249' ' ' HIS . . . . . 0.405 ' O ' ' HD3' ' A' ' 253' ' ' LYS . 19.4 m-70 -66.64 -39.56 88.32 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 250' ' ' PHE . . . . . 0.457 ' CE2' HD11 ' A' ' 311' ' ' LEU . 3.1 m-85 -62.28 -48.96 77.6 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.005 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.6 pt-20 -61.47 -35.07 76.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.231 0.538 . . . . 0.0 109.644 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.05 83.06 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.282 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 253' ' ' LYS . . . . . 0.405 ' HD3' ' O ' ' A' ' 249' ' ' HIS . 1.9 mptm? -61.03 -46.59 90.09 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.725 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.505 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.5 tp -63.67 -37.09 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.218 -0.447 . . . . 0.0 109.891 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -56.61 -51.43 68.67 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.036 0.446 . . . . 0.0 109.87 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -61.99 -42.65 99.38 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -55.37 -44.31 75.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.199 0.523 . . . . 0.0 110.199 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -62.12 -40.15 94.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.024 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -57.8 -46.33 84.8 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.117 0.484 . . . . 0.0 110.514 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -63.69 -36.36 83.59 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -58.88 -48.33 81.8 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.03 -44.88 94.33 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -63.34 -37.54 87.68 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.082 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.74 -41.86 97.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.37 -48.13 82.66 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.39 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 63.6 mt -62.15 -42.82 96.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.333 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.65 -36.91 82.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.349 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -63.34 -46.41 86.69 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.091 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.28 -45.72 92.35 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.135 0.493 . . . . 0.0 110.604 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.66 -37.77 85.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.42 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.22 -43.8 98.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.23 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -61.33 -43.24 99.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.309 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 273' ' ' HIS . . . . . 0.44 ' O ' ' OG ' ' A' ' 276' ' ' SER . 78.2 m80 -69.49 -40.15 77.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.756 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.647 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.6 -38.3 89.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.4 -24.43 67.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.667 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 276' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 273' ' ' HIS . 78.7 p -78.59 -5.84 53.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.637 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 274' ' ' ALA . 10.6 p -60.1 -30.13 45.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.444 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 102.42 -72.04 0.32 Allowed Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -65.01 139.09 58.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.779 0.324 . . . . 0.0 110.544 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -92.01 126.77 8.64 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -166.11 -78.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.821 0.343 . . . . 0.0 110.482 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -72.75 -6.63 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 54.7 t -64.2 -45.17 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.533 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 1.1 p -62.2 -44.87 95.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.848 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -62.15 -44.28 96.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 t -60.86 -45.39 94.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.537 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -63.57 -35.29 80.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.417 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -60.8 -61.95 2.21 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.23 0.538 . . . . 0.0 110.363 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.555 ' HD3' HD23 ' A' ' 292' ' ' LEU . 11.4 mmtm -62.01 -35.4 78.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.116 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -51.27 -48.42 62.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.879 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.07 76.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.555 HD23 ' HD3' ' A' ' 289' ' ' LYS . 17.0 tp -62.06 -52.4 64.06 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.55 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 8.8 mp -63.47 -42.59 98.59 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.196 0.522 . . . . 0.0 110.097 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.592 ' O ' ' OG1' ' A' ' 297' ' ' THR . 83.2 tt0 -63.28 -36.37 83.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.817 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.21 -44.13 97.54 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 296' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 296' ' ' ARG . 16.5 tpp180 -60.12 -43.11 95.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.468 . . . . 0.0 110.176 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.592 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 19.9 p -58.34 -43.36 88.24 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -39.85 95.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.358 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -58.41 -49.2 78.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.329 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 300' ' ' LEU . . . . . 0.427 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.7 OUTLIER -60.35 -43.55 96.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.512 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.27 -42.57 82.87 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -63.65 -47.14 82.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.054 0.454 . . . . 0.0 110.655 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 303' ' ' THR . . . . . 0.429 HG22 ' ND1' ' A' ' 307' ' ' HIS . 10.8 m -61.5 -43.78 98.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.723 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.39 -41.82 88.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -60.19 -50.38 73.89 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-O 121.153 0.501 . . . . 0.0 110.535 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -63.04 -39.98 96.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.459 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.429 ' ND1' HG22 ' A' ' 303' ' ' THR . 3.4 m170 -66.69 -33.65 76.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.997 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.533 HD21 HG21 ' A' ' 223' ' ' VAL . 3.9 mt -61.81 -46.12 90.89 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.661 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -68.31 -41.89 80.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.52 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.07 -47.17 84.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.886 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.457 HD11 ' CE2' ' A' ' 250' ' ' PHE . 26.8 mt -62.05 -43.2 99.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.964 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 78.4 p -62.74 -36.63 83.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.511 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.27 -45.04 83.84 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 314' ' ' ARG . . . . . 0.503 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.85 -43.0 97.44 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.029 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 315' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 315' ' ' ILE . 55.8 mt -86.55 -2.62 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.739 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 46.9 t -59.15 -44.3 92.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.299 0.571 . . . . 0.0 109.464 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.5 ptp85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.233 -0.894 . . . . 0.0 108.866 178.961 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 . . . . . 0 C--O 1.234 0.277 0 CA-C-O 120.676 0.274 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.513 ' C ' ' SD ' ' A' ' 22' ' ' MET . 87.7 mtm180 -93.8 8.61 40.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.734 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.513 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -136.21 133.88 37.55 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.263 0.554 . . . . 0.0 110.711 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 58.4 mp0 -65.72 -35.91 82.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.594 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' O ' HD23 ' A' ' 28' ' ' LEU . 64.8 mttp -58.65 -49.38 77.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.102 0.477 . . . . 0.0 110.506 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.89 -34.85 78.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.756 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -66.36 -40.67 89.93 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.54 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -62.97 -45.97 89.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.596 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 24' ' ' LYS . 3.4 mm? -61.88 -41.55 98.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.562 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.645 ' CH2' HD11 ' A' ' 42' ' ' LEU . 55.6 t-105 -62.29 -45.94 91.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.12 0.486 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.62 -45.26 89.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.694 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.24 -41.65 97.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.478 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.34 -41.7 97.48 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.552 ' O ' ' ND1' ' A' ' 36' ' ' HIS . 99.2 mt-30 -61.89 -39.29 91.43 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.076 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.549 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 85.5 mmt-85 -64.47 -38.99 92.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.601 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.7 -39.18 93.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.752 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.572 ' C ' HD23 ' A' ' 37' ' ' LEU . 66.5 m-70 66.21 106.58 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.818 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.576 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -132.21 155.8 80.86 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.51 179.844 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.437 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 72.5 Cg_exo -42.31 153.38 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.545 2.163 . . . . 0.0 112.364 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 31.0 Cg_exo -59.3 -40.54 67.34 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.734 2.29 . . . . 0.0 112.23 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 79.1 t -62.07 -47.08 94.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.548 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttm-85 -65.8 -42.13 91.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.539 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.645 HD11 ' CH2' ' A' ' 29' ' ' TRP . 48.5 tp -63.6 -45.16 91.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.69 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.77 -46.68 86.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.55 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -66.63 -42.52 86.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.421 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.588 HD13 ' OH ' ' A' ' 88' ' ' TYR . 59.0 tp -63.53 -51.2 66.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.848 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -58.07 -41.96 84.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.481 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.563 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.84 -47.31 86.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.544 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -56.18 -47.36 78.46 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.458 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.426 HD13 ' O ' ' A' ' 45' ' ' LEU . 6.9 mp -59.63 -40.29 87.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.035 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -58.85 -38.36 78.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 47' ' ' ALA . 28.3 mm -63.66 -42.52 96.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.785 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -57.72 -47.2 83.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.542 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -59.8 -50.51 73.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.26 0.552 . . . . 0.0 110.227 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 54' ' ' ARG . 71.3 mmt-85 -62.03 -41.0 97.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.564 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.413 ' O ' ' OD1' ' A' ' 55' ' ' ASP . 66.5 t0 -62.7 -39.28 93.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.543 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -60.03 -47.69 84.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.989 0.423 . . . . 0.0 110.152 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.75 -41.24 97.42 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.366 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.39 98.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.47 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.491 ' CH2' ' HD2' ' A' ' 63' ' ' LYS . 86.5 t90 -60.77 -41.28 95.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.343 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -61.3 -46.93 88.25 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -62.62 -43.14 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.406 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.5 mt -62.18 -41.49 98.37 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.146 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.491 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 88.6 tttt -60.69 -42.05 96.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 179.555 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.49 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.527 0.833 0 N-CA-C 111.014 -0.835 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -68.61 -34.87 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.761 0.315 . . . . 0.0 110.592 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -60.63 -60.74 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.967 0.413 . . . . 0.0 110.251 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 18.0 pt-20 -56.36 -42.09 77.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.135 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.564 ' HB1' HH12 ' A' ' 79' ' ' ARG . . . -60.25 -40.7 91.25 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.265 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -61.3 -40.83 95.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -63.5 -43.36 97.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.128 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.79 -48.73 86.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.745 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.564 HH12 ' HB1' ' A' ' 75' ' ' ALA . 94.8 mtm-85 -60.91 -40.41 93.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.086 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.449 ' O ' HG13 ' A' ' 84' ' ' ILE . 7.2 t-20 -63.41 -37.98 89.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.375 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.687 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.7 -47.53 84.21 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.189 0.519 . . . . 0.0 109.847 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.5 m-20 -65.45 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.616 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 79' ' ' ARG . 72.2 t -62.79 -45.54 98.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.356 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.65 -48.39 87.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.268 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.2 mm? -64.95 -41.03 95.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.965 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.23 98.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.655 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -62.54 -48.06 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.538 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.588 ' OH ' HD13 ' A' ' 45' ' ' LEU . 9.6 m-85 -69.07 -23.44 64.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.295 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.25 22.55 75.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.5 mt . . . . . 0 C--N 1.33 -0.273 0 CA-C-O 120.776 0.322 . . . . 0.0 110.484 -179.893 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.449 ' N ' HD12 ' A' ' 117' ' ' LEU . 8.3 mp . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.825 0.345 . . . . 0.0 110.769 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -58.95 -33.31 70.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.478 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 66.6 mttm -61.25 -48.1 82.99 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.639 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.474 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 35.5 mt -66.75 -44.16 82.2 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.773 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.539 ' CD2' HD22 ' A' ' 135' ' ' LEU . 6.8 t-105 -59.22 -50.3 74.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.483 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -67.8 -32.2 72.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.266 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 127' ' ' SER . 10.8 tptt -56.94 -51.45 69.12 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.82 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.4 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.82 -47.03 64.31 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.554 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -53.86 -50.23 66.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.482 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -73.95 -42.83 59.94 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 123' ' ' LYS . 80.0 p -44.38 -29.58 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.01 0.433 . . . . 0.0 109.917 -178.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -161.4 -96.74 0.11 Allowed Glycine 0 N--CA 1.463 0.44 0 C-N-CA 119.848 -1.168 . . . . 0.0 111.581 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.787 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -154.91 22.75 0.44 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.463 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.2 m-30 -56.36 49.13 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.644 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.787 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -105.82 121.14 43.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.215 -179.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 114.63 -97.08 0.8 Allowed Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.211 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -77.33 -43.93 31.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.784 0.326 . . . . 0.0 110.989 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.463 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 58.5 mp0 -61.64 -51.74 67.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.018 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.539 HD22 ' CD2' ' A' ' 121' ' ' TRP . 1.1 mt -62.14 -40.86 97.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.261 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.69 -43.31 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -60.53 -42.57 96.76 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-O 121.199 0.523 . . . . 0.0 110.138 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mt -58.32 -43.52 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -66.81 -35.24 79.62 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.934 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -54.05 -41.4 68.08 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.076 -1.049 . . . . 0.0 108.227 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.684 ' OE1' HD21 ' A' ' 204' ' ' LEU . 50.5 mt-10 -71.45 -41.73 69.08 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.753 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.474 ' HZ ' HD13 ' A' ' 120' ' ' LEU . 3.5 m-85 -59.39 -57.7 11.83 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.66 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.467 HD23 ' HD2' ' A' ' 146' ' ' LYS . 95.8 mt -60.16 -38.98 84.82 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.206 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -54.99 -46.14 75.1 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.028 -0.669 . . . . 0.0 109.54 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.466 ' CE1' HG23 ' A' ' 197' ' ' ILE . 6.7 m-70 -60.88 -40.01 91.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.681 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.467 ' HD2' HD23 ' A' ' 143' ' ' LEU . 68.1 mttm -60.88 -44.47 97.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.456 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -70.18 -46.4 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.388 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.37 -47.04 85.92 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.05 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 37.3 t -64.56 -41.74 93.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.71 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.747 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -58.17 -44.31 87.9 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.327 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.56 -40.03 95.94 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.98 -50.28 69.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.954 0.406 . . . . 0.0 110.575 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -72.2 -43.75 64.03 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 150' ' ' HIS . 78.9 t -60.3 -46.71 94.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.943 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 79.2 mt . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.708 179.354 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 . . . . . 0 CA--C 1.519 -0.215 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 5.4 mt -62.91 -46.21 88.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -69.69 -42.14 74.51 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.281 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -68.83 -43.01 76.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.565 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.552 ' O ' ' OG ' ' A' ' 196' ' ' SER . 20.5 pttt -74.24 -44.15 54.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.508 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.743 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.36 -41.69 80.28 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.875 -179.629 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.535 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.1 ptm180 -66.24 -37.31 85.2 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.552 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 91.9 p -59.09 -40.0 83.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.466 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.8 mt -63.64 -43.57 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.251 178.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -63.37 -41.02 98.8 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.636 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.456 HE22 HH12 ' A' ' 195' ' ' ARG . 95.8 mt-30 -61.11 -40.45 93.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.456 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.09 -41.26 97.99 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 201' ' ' LEU . 19.7 mt -62.4 -41.09 98.4 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.059 179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.585 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.3 OUTLIER -63.27 -36.05 82.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.544 ' HA ' ' HE ' ' A' ' 206' ' ' ARG . 3.5 tmm_? -63.46 -42.61 98.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.538 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.684 HD21 ' OE1' ' A' ' 141' ' ' GLU . 40.6 mt -62.15 -40.08 94.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.293 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.523 ' O ' ' ND1' ' A' ' 209' ' ' HIS . 74.4 mtp85 -62.39 -42.67 99.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.086 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.754 ' O ' ' N ' ' A' ' 210' ' ' GLN . 85.2 mtm180 -64.72 -39.32 93.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.183 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.528 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 41.3 t -64.75 -44.32 96.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.105 0.479 . . . . 0.0 110.521 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.6 m -73.93 -26.7 60.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.484 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 209' ' ' HIS . . . . . 0.523 ' ND1' ' O ' ' A' ' 205' ' ' ARG . 57.0 m80 -100.57 -26.18 13.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.176 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.754 ' N ' ' O ' ' A' ' 206' ' ' ARG . 42.9 tp60 -119.7 -29.62 4.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.881 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.528 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.482 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.546 ' O ' ' C ' ' A' ' 220' ' ' GLU . 84.2 tt0 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.222 0.058 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.546 ' C ' ' O ' ' A' ' 219' ' ' GLU . 23.7 tt0 27.06 94.3 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.609 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -47.96 82.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.471 2.114 . . . . 0.0 112.132 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 220' ' ' GLU . 56.8 ttm-85 -162.24 -50.9 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.585 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.479 HG23 ' H ' ' A' ' 224' ' ' ILE . 0.0 OUTLIER -64.59 -71.96 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.607 0 CA-C-O 121.328 0.585 . . . . 0.0 110.832 -179.684 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.479 ' H ' HG23 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -60.01 -25.58 33.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.342 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.14 -43.97 85.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.35 0.595 . . . . 0.0 109.64 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.41 -41.97 97.98 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -61.71 -36.66 81.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.798 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.63 -37.45 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.214 0.531 . . . . 0.0 109.745 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.666 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.0 mt -64.39 -41.49 96.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.82 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 235' ' ' LEU . . . -58.54 10.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.868 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.795 ' O ' HD21 ' A' ' 240' ' ' LEU . 17.1 pt20 -76.78 -47.44 21.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.703 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.43 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 76.8 p -129.66 9.52 5.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.644 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 233' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 234' ' ' ASN . . . -56.58 -49.6 74.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.578 -179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 234' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 233' ' ' ALA . 29.7 t30 173.66 74.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.636 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.494 HD12 ' N ' ' A' ' 235' ' ' LEU . 0.7 OUTLIER -136.05 172.64 12.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 -179.6 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 43.2 p -94.07 167.02 11.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.72 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -62.52 -48.38 79.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.064 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.95 -45.0 95.58 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.43 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -62.5 -34.9 77.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.634 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.795 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -63.14 -41.51 99.31 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.534 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -63.85 -51.42 64.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.69 98.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.1 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -64.04 -43.14 96.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.91 178.838 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -57.3 -51.19 70.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.358 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -66.51 -40.37 89.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.585 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -59.36 -51.04 71.65 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.402 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.414 ' HG ' ' CE2' ' A' ' 243' ' ' PHE . 4.3 mm? -64.29 -37.04 86.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.563 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.691 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 33.6 ttpt -56.46 -43.8 79.92 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.192 0.52 . . . . 0.0 110.184 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -69.58 -42.71 74.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.488 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 250' ' ' PHE . . . . . 0.524 ' CE2' HD11 ' A' ' 311' ' ' LEU . 3.1 m-85 -61.93 -48.74 79.05 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.21 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.691 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 2.5 pp20? -60.27 -38.33 83.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.134 0.492 . . . . 0.0 109.905 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 252' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 251' ' ' GLU . . . -66.64 -36.59 82.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.366 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.23 -47.61 83.67 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.174 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.457 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.7 OUTLIER -65.1 -41.91 93.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.592 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 255' ' ' GLU . . . . . 0.401 ' N ' HG23 ' A' ' 254' ' ' ILE . 49.6 tp10 -61.4 -46.73 88.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.319 0.58 . . . . 0.0 110.112 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.57 -41.72 98.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.332 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -55.02 -45.44 75.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.124 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -61.3 -42.94 99.5 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.15 0.5 . . . . 0.0 110.19 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.4 -41.18 96.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.166 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 260' ' ' TYR . . . . . 0.425 ' O ' ' N ' ' A' ' 264' ' ' LEU . 26.0 m-85 -63.65 -37.29 86.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.522 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 261' ' ' GLN . . . . . 0.481 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 35.3 mm-40 -60.3 -52.02 67.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.229 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.69 -45.31 94.66 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.081 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -67.37 -30.44 70.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.277 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 264' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' A' ' 260' ' ' TYR . 46.4 tp -63.52 -45.4 90.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.047 0.451 . . . . 0.0 110.308 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.37 -47.63 69.84 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.519 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 97.6 mt -62.42 -43.06 97.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.943 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.056 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -59.56 -46.94 87.43 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.08 0.466 . . . . 0.0 110.193 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -62.6 -43.82 97.85 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.278 0.561 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.08 -39.51 90.18 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.327 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.728 HD23 ' C ' ' A' ' 271' ' ' LEU . 7.4 tt -59.85 -43.83 94.44 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.3 ttt85 -58.45 -44.46 89.24 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.126 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -68.52 -40.2 80.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.567 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.619 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -57.24 -44.21 83.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.692 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 275' ' ' GLU . . . . . 0.587 ' OE2' HD21 ' A' ' 271' ' ' LEU . 92.2 mt-10 -61.66 -22.28 65.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.494 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.5 t -91.85 5.84 48.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.626 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.619 HG12 ' O ' ' A' ' 274' ' ' ALA . 14.5 p -62.44 -43.66 98.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.61 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.556 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 166.41 -111.83 0.47 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -61.53 -41.01 96.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.78 0.324 . . . . 0.0 110.563 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 280' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 281' ' ' GLU . . . 152.72 -111.69 0.5 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 281' ' ' GLU . . . . . 0.636 ' C ' ' H ' ' A' ' 283' ' ' VAL . 95.5 mt-10 58.9 152.66 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 282' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' A' ' 281' ' ' GLU . 96.8 mtt180 64.26 -19.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 283' ' ' VAL . . . . . 0.636 ' H ' ' C ' ' A' ' 281' ' ' GLU . 8.9 p -67.91 -47.42 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.696 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 284' ' ' SER . . . . . 0.596 ' N ' HG13 ' A' ' 283' ' ' VAL . 42.1 m -63.41 -44.94 93.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.941 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -65.73 -43.53 88.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.833 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 59.1 m -61.11 -44.98 96.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.794 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 287' ' ' ARG . . . . . 0.553 ' NH2' ' OE2' ' A' ' 275' ' ' GLU . 94.8 mtt-85 -66.03 -39.61 90.34 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.189 0.519 . . . . 0.0 111.045 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.97 -59.21 5.82 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.073 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.647 ' HD3' HD23 ' A' ' 292' ' ' LEU . 54.6 mmtt -63.41 -39.88 95.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.07 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -41.81 -57.78 2.24 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.382 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.37 80.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.717 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.647 HD23 ' HD3' ' A' ' 289' ' ' LYS . 35.6 tp -60.65 -49.87 75.77 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.499 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 293' ' ' LEU . . . . . 0.442 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.8 mp -64.93 -41.63 95.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.978 0.418 . . . . 0.0 110.06 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -58.93 -45.35 90.59 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.182 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.28 -43.83 98.54 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -62.72 -38.87 92.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.419 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.481 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 1.5 m -60.75 -51.71 68.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.395 0.617 . . . . 0.0 110.076 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -65.3 -44.95 86.27 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.246 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -58.39 -38.01 76.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.987 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 300' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 300' ' ' LEU . 0.2 OUTLIER -62.72 -42.82 99.85 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.66 -46.19 93.68 Favored Glycine 0 CA--C 1.53 1.009 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.62 -43.51 93.75 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 110.45 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.8 m -60.26 -41.64 93.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.128 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.83 -43.86 89.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -57.6 -55.11 39.07 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.244 0.545 . . . . 0.0 110.619 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -62.73 -38.47 90.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.425 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -63.35 -38.01 89.51 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.279 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 6.8 mt -62.02 -44.56 96.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.343 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -70.59 -43.2 69.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.704 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -63.34 -46.02 88.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.836 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 250' ' ' PHE . 23.9 mt -63.43 -42.11 98.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.92 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 67.8 m -58.97 -44.29 91.5 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.362 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -71.04 -36.64 64.35 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -63.2 -43.89 96.91 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.732 0.301 . . . . 0.0 110.758 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 315' ' ' ILE . . . . . 0.591 ' O ' ' N ' ' A' ' 317' ' ' ARG . 2.3 mt -81.29 -97.16 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.904 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 316' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 315' ' ' ILE . 0.4 OUTLIER 35.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.095 0.474 . . . . 0.0 110.444 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.591 ' N ' ' O ' ' A' ' 315' ' ' ILE . 17.6 ptp180 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.465 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.435 ' CD1' HD23 ' A' ' 25' ' ' LEU . 67.0 m-85 . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.74 0.305 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 21' ' ' ARG . 68.3 mtt180 -94.4 16.45 15.14 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.901 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.581 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.5 mmt -142.29 133.9 26.75 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.113 0.482 . . . . 0.0 111.217 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -67.3 -43.99 80.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.539 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -60.01 -45.69 91.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.419 0.628 . . . . 0.0 110.5 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.435 HD23 ' CD1' ' A' ' 20' ' ' PHE . 5.3 tp -60.76 -38.77 86.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.402 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.581 ' ND2' ' O ' ' A' ' 22' ' ' MET . 49.6 m-80 -62.37 -39.29 92.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.814 179.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -57.59 -46.25 84.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.258 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -61.42 -43.2 99.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.095 0.474 . . . . 0.0 110.41 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.404 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 24.8 t-105 -60.91 -45.41 94.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.235 0.54 . . . . 0.0 110.595 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.41 -40.61 87.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.264 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.402 ' HG2' ' NH2' ' A' ' 34' ' ' ARG . 67.3 mttm -60.57 -43.3 97.44 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.255 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.99 97.17 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.284 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.404 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.3 mt-30 -58.16 -45.07 88.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.344 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.531 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 93.7 mtm-85 -65.65 -33.98 77.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.48 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.459 HD12 ' HA ' ' A' ' 35' ' ' LEU . 14.3 tp -62.09 -37.57 85.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.127 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.531 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 54.4 m-70 65.94 109.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 mt -139.3 154.96 72.4 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.02 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 154.6 0.1 OUTLIER 'Trans proline' 0 C--N 1.312 -1.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.26 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.14 -34.7 16.02 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.461 2.108 . . . . 0.0 112.321 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.49 -48.91 81.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.617 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -69.94 -39.97 75.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.586 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.7 -43.89 95.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.586 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.09 -44.4 84.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.612 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -66.88 -45.73 77.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.643 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.405 HD22 ' OH ' ' A' ' 88' ' ' TYR . 57.1 tp -62.67 -47.91 81.61 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.534 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 54.0 t60 -59.03 -40.71 85.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.973 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.93 -45.13 93.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.812 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.07 -46.4 85.5 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.915 0.388 . . . . 0.0 110.409 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 40.6 mt -60.01 -40.84 90.65 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.128 0.489 . . . . 0.0 110.158 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -59.0 -39.64 82.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.059 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.4 mm -62.13 -43.8 98.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.648 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -55.74 -44.83 77.95 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.389 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -60.41 -46.73 88.94 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.261 0.553 . . . . 0.0 110.425 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.62 -43.34 93.84 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.7 -38.64 85.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.115 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -58.07 -47.32 83.52 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 16.0 mt -60.84 -42.6 98.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.391 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.09 99.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.5 t90 -57.6 -43.14 84.46 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.135 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.66 -45.87 92.19 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.03 0.443 . . . . 0.0 109.931 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.09 -44.45 91.91 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.431 ' CD2' ' NZ ' ' A' ' 73' ' ' LYS . 7.2 mp -62.72 -39.04 92.82 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.848 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.51 -44.55 76.73 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 30.6 mt . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.038 179.131 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.776 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -60.46 -33.97 73.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.431 ' NZ ' ' CD2' ' A' ' 62' ' ' LEU . 98.4 mttt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.042 0.449 . . . . 0.0 110.096 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -58.07 -42.88 86.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.147 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.51 92.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.371 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.407 ' HA ' ' HE ' ' A' ' 79' ' ' ARG . 61.3 ttp180 -60.37 -42.73 96.42 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.62 -42.83 99.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.7 -45.52 97.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.626 ' O ' HG23 ' A' ' 83' ' ' VAL . 88.8 mtm180 -61.58 -41.73 97.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.205 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -63.9 -38.94 92.95 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.294 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.741 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.9 tm? -59.54 -48.52 81.32 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.755 -0.778 . . . . 0.0 109.841 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -63.6 -38.67 92.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.639 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 79' ' ' ARG . 78.2 t -62.81 -46.42 96.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.346 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.32 -48.89 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.52 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.49 -40.8 93.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.4 . . . . 0.0 110.897 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.85 -47.74 83.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.68 -44.13 97.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.104 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.405 ' OH ' HD22 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -63.43 -34.69 78.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.106 0.479 . . . . 0.0 109.954 179.739 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.46 25.9 55.76 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' ' 90' ' ' LEU . 45.9 mt . . . . . 0 C--O 1.231 0.107 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.513 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.237 0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.408 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.475 ' HB3' ' CE1' ' A' ' 122' ' ' HIS . 99.1 mt-10 -54.84 -24.65 24.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.259 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 57.0 mtpt -60.15 -49.72 76.53 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.096 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.87 -44.75 69.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.975 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.69 ' CE2' HD13 ' A' ' 135' ' ' LEU . 9.2 t-105 -59.07 -48.84 80.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.49 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 118' ' ' GLU . 3.9 m80 -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.435 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.2 OUTLIER -55.91 -51.28 68.16 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.729 -178.812 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.29 -46.7 63.76 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.814 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -51.68 -51.53 55.18 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.648 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -76.68 -41.99 43.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.821 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.9 t -45.55 -27.34 0.73 Allowed 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.062 0.458 . . . . 0.0 109.912 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.12 -91.79 0.08 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.426 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.541 ' O ' ' N ' ' A' ' 131' ' ' SER . 11.8 ptmt -165.62 31.03 0.05 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.413 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -65.13 43.4 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.341 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.541 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -98.36 123.54 42.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.651 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 112.7 -97.29 0.88 Allowed Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.076 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -78.61 -43.24 26.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.749 0.309 . . . . 0.0 111.246 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 77.3 mm-40 -60.97 -51.97 66.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 0.0 110.142 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.69 HD13 ' CE2' ' A' ' 121' ' ' TRP . 2.2 mt -62.43 -42.89 99.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.035 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.21 -39.95 92.15 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 2.9 mmpt? -61.49 -42.1 98.28 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.281 0.562 . . . . 0.0 109.869 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mt -58.05 -43.39 86.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -36.15 82.74 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 176.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.507 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 6.5 mpt_? -54.12 -42.95 70.03 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.522 ' OE1' ' O ' ' A' ' 137' ' ' LYS . 5.6 mp0 -70.09 -41.86 73.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.825 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -61.06 -53.73 53.52 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.693 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 98.9 mt -59.92 -40.71 89.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.097 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' A' ' 140' ' ' ARG . 6.4 m80 -56.48 -44.28 80.48 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.478 ' O ' HG12 ' A' ' 149' ' ' VAL . 9.5 m-70 -63.28 -38.68 92.11 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.592 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -60.82 -43.14 98.6 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.106 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.531 ' HA ' ' CE1' ' A' ' 150' ' ' HIS . 98.1 mt-10 -69.83 -45.71 67.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.002 0.429 . . . . 0.0 111.684 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -70.65 -44.53 66.9 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.481 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.6 HG13 ' N ' ' A' ' 150' ' ' HIS . 4.4 p -63.44 -49.34 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.983 -178.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.783 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -70.51 -23.25 62.62 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.004 -179.39 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.613 ' HG3' ' CE1' ' A' ' 150' ' ' HIS . 24.6 mt-10 -67.18 -52.28 43.3 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.814 179.091 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -63.25 -41.53 99.07 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -63.92 -40.1 95.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.231 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 150' ' ' HIS . 19.8 t -60.38 -47.65 91.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.042 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 97.2 mt . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.844 179.907 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 . . . . . 0 CA--C 1.521 -0.173 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 5.3 mt -62.3 -46.68 87.69 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.556 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.442 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.8 mttt -68.6 -38.27 80.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.942 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 85.4 tt0 -67.81 -48.21 66.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.764 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 14.3 pttt -73.2 -41.18 64.09 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.011 -179.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.705 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.52 -41.77 72.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.849 -179.4 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.523 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 12.8 ptm180 -65.72 -38.99 90.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.0 -42.29 98.16 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 193' ' ' LYS . 82.2 mt -64.42 -43.86 97.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.761 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -62.09 -41.7 98.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.504 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.29 -31.94 73.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.338 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.57 78.41 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 201' ' ' LEU . 24.8 mt -63.22 -40.8 98.5 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.864 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.56 -39.96 93.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -41.76 99.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.497 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.449 HD12 HD23 ' A' ' 201' ' ' LEU . 31.9 mt -60.9 -40.66 93.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.449 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -62.2 -44.24 97.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.294 0.569 . . . . 0.0 109.668 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.547 ' O ' ' N ' ' A' ' 210' ' ' GLN . 24.2 mmt85 -63.73 -39.54 94.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.069 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 211' ' ' GLY . 48.5 t -62.99 -45.64 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.042 0.449 . . . . 0.0 109.897 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 15.6 m -63.39 -29.51 70.8 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.339 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.9 m170 -93.57 -46.03 7.47 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.69 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 206' ' ' ARG . 2.9 pp0? -105.56 -25.57 12.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.657 0.265 . . . . 0.0 111.112 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 N--CA 1.459 0.202 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 . . . . . 0 C--O 1.233 0.193 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.97 151.24 86.31 Favored Pre-proline 0 C--O 1.235 0.325 0 C-N-CA 119.136 -1.025 . . . . 0.0 108.314 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.616 ' O ' ' N ' ' A' ' 223' ' ' VAL . 78.0 Cg_exo -38.26 -79.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.28 1.987 . . . . 0.0 112.418 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.413 ' H ' ' HB2' ' A' ' 221' ' ' PRO . 43.6 ttm180 36.09 -84.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.092 0.472 . . . . 0.0 111.402 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.817 HG11 HD21 ' A' ' 308' ' ' LEU . 2.1 t -59.75 -65.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.139 0.495 . . . . 0.0 110.691 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.414 HD11 ' HE1' ' A' ' 250' ' ' PHE . 1.1 mp -51.19 -28.03 6.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.754 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 225' ' ' ASP . . . . . 0.409 ' HB3' ' O ' ' A' ' 222' ' ' ARG . 56.6 t0 -63.51 -45.91 88.47 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 109.868 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.1 mt -61.2 -42.13 98.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.596 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.452 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 44.2 m0 -61.49 -36.67 81.12 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.355 -0.538 . . . . 0.0 109.949 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.8 -40.21 94.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 231' ' ' GLN . 96.8 mt -64.02 -41.81 97.33 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.263 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 227' ' ' TRP . . . -36.68 -29.39 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.999 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 229' ' ' LEU . 89.1 mt-30 -62.49 -65.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.715 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 5.4 t -87.05 14.69 7.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.688 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -80.47 -76.1 0.24 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.805 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -173.26 81.66 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.905 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 76.5 mt -141.54 149.26 40.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.615 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 240' ' ' LEU . 70.4 p -71.3 -167.01 0.2 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.407 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 237' ' ' ASP . . . . . 0.472 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 27.0 p-10 -82.53 -47.82 11.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.327 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 238' ' ' LYS . . . . . 0.401 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 65.1 mttp -63.38 -44.33 95.03 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.081 0.467 . . . . 0.0 110.625 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -62.3 -36.45 82.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.686 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.758 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.2 -45.0 93.73 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.535 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -62.08 -46.73 87.81 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.465 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -63.24 -40.85 98.6 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.06 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.526 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -65.71 -43.73 88.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.52 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 244' ' ' ARG . . . . . 0.401 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 0.0 OUTLIER -59.99 -48.21 82.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.009 0.433 . . . . 0.0 110.441 -178.703 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -65.19 -46.08 82.2 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.825 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -57.27 -50.17 73.76 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.071 0.462 . . . . 0.0 110.345 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.97 -37.39 87.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.687 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.4 tttt -55.28 -47.63 75.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.061 0.458 . . . . 0.0 109.866 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -67.48 -43.77 80.16 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.076 -0.649 . . . . 0.0 110.989 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 250' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 29.9 t80 -60.65 -48.06 83.46 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.509 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.9 OUTLIER -61.86 -36.63 81.81 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.04 -41.6 90.66 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.826 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.45 -46.9 86.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 111.137 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -38.81 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.791 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -55.83 -48.8 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.343 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -62.24 -43.11 99.57 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.26 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -57.83 -43.1 85.6 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.131 0.491 . . . . 0.0 110.291 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -61.52 -40.97 96.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.364 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -59.18 -46.69 87.74 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 120.954 0.407 . . . . 0.0 110.285 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 260' ' ' TYR . . . . . 0.56 ' CD2' HD11 ' A' ' 293' ' ' LEU . 3.3 m-85 -62.07 -37.5 85.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.28 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -61.6 -42.62 99.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.524 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 24.1 mmtp -62.0 -45.64 92.74 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.098 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -66.34 -35.99 81.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.148 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.31 -43.73 98.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.39 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.46 -45.38 83.98 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.677 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 55.9 mt -62.97 -43.27 98.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.734 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.14 -38.63 83.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.035 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.29 -47.42 86.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.407 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -58.43 -48.85 79.37 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.361 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -61.11 -37.66 83.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.729 HD23 ' O ' ' A' ' 271' ' ' LEU . 4.7 tt -59.81 -44.26 94.07 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 -179.696 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -61.35 -44.81 96.55 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.078 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.49 -44.6 82.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.863 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.03 -34.69 73.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -59.92 -35.16 74.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.962 0.411 . . . . 0.0 110.116 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 15.6 m -61.25 -31.47 71.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.834 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.34 -44.04 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.453 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 105.03 6.1 40.12 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 279' ' ' ASP . . . . . 0.433 ' O ' HG23 ' A' ' 283' ' ' VAL . 48.9 t0 -84.35 100.47 11.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.379 . . . . 0.0 110.127 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.3 86.87 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -55.58 -50.8 69.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.582 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -66.53 -38.28 86.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.93 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 283' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 279' ' ' ASP . 72.5 t -60.87 -47.29 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.48 -46.4 88.65 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.054 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -62.44 -43.03 99.81 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.706 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.2 t -60.47 -45.14 94.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.459 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -64.07 -36.65 84.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.708 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.61 -58.87 6.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.551 ' HD3' HD23 ' A' ' 292' ' ' LEU . 28.5 mmtt -64.34 -33.48 75.94 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.061 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -55.26 -48.67 73.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.443 -0.503 . . . . 0.0 109.919 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.84 -39.1 80.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.964 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.551 HD23 ' HD3' ' A' ' 289' ' ' LYS . 8.5 tp -62.28 -54.92 33.71 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.736 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 293' ' ' LEU . . . . . 0.56 HD11 ' CD2' ' A' ' 260' ' ' TYR . 9.8 tp -62.65 -42.43 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.181 0.515 . . . . 0.0 109.958 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.484 ' O ' ' OG1' ' A' ' 297' ' ' THR . 81.7 tt0 -63.35 -36.98 85.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.993 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.47 -45.71 94.21 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -60.56 -44.03 96.63 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.056 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 21.9 p -59.39 -39.84 84.66 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.563 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.77 -47.47 83.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.029 0.442 . . . . 0.0 110.838 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.2 -41.29 92.67 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.092 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 300' ' ' LEU . . . . . 0.43 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.1 OUTLIER -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.953 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.44 -40.0 91.47 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -61.54 -46.7 88.82 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 110.486 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 17.7 m -60.34 -45.21 94.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.542 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.98 -42.18 91.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.854 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -56.59 -48.75 76.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.752 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -61.56 -42.89 99.5 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.185 0.517 . . . . 0.0 110.457 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -68.95 -31.09 69.71 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.311 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.817 HD21 HG11 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -61.94 -49.01 77.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.327 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 309' ' ' GLN . . . . . 0.421 ' HG3' ' N ' ' A' ' 310' ' ' ASP . 12.5 pt20 -67.88 -42.0 81.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 310' ' ' ASP . . . . . 0.444 ' OD1' ' NE ' ' A' ' 314' ' ' ARG . 48.4 t0 -62.29 -51.1 69.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.995 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.45 -40.19 95.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.883 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 66.5 m -58.58 -44.79 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.64 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -70.13 -45.47 55.98 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.462 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 314' ' ' ARG . . . . . 0.444 ' NE ' ' OD1' ' A' ' 310' ' ' ASP . 95.1 mtt-85 -63.44 -47.52 81.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.724 0.297 . . . . 0.0 111.23 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -65.59 -43.19 94.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.643 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.0 p -58.51 -38.08 76.94 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.508 -0.477 . . . . 0.0 109.932 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 43.2 tpt85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.775 -179.573 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 C--O 1.233 0.22 0 CA-C-O 120.826 0.346 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -65.47 -34.62 78.7 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.0 mmm -124.18 149.92 45.78 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.405 0.621 . . . . 0.0 110.648 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 52.5 mp0 -61.62 -41.71 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.424 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -46.08 -57.04 4.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.173 0.511 . . . . 0.0 110.494 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.5 mt -59.79 -35.38 74.55 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.867 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -64.55 -39.35 93.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.394 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.36 -46.87 88.41 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.14 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -59.77 -41.82 91.91 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.46 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 29.1 t-105 -59.92 -43.41 94.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 0.0 110.401 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -57.9 -41.98 83.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.206 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -61.25 -41.58 97.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.39 95.17 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.324 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.473 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 76.6 mt-30 -62.39 -38.4 89.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.32 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.527 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.0 mt -65.27 -38.37 90.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.446 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.35 109.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.3 mt -134.42 154.9 80.07 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -37.91 154.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.816 2.344 . . . . 0.0 112.202 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.95 -47.02 2.73 Favored 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.736 2.29 . . . . 0.0 112.551 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.432 HG23 ' N ' ' A' ' 41' ' ' ARG . 5.6 m -61.31 -47.18 94.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.452 -179.283 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.432 ' N ' HG23 ' A' ' 40' ' ' VAL . 61.4 ttm-85 -64.9 -40.64 95.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.434 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.14 -43.92 97.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.58 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.69 97.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.514 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -66.19 -47.09 75.06 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.618 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.01 -47.75 85.0 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.374 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.459 ' CD2' ' HD2' ' A' ' 50' ' ' LYS . 24.4 t60 -59.24 -41.25 88.3 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.293 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.415 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.55 -44.46 93.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.391 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -58.4 -45.79 87.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.137 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.1 mt -58.51 -41.49 85.53 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.178 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.459 ' HD2' ' CD2' ' A' ' 46' ' ' HIS . 51.6 mtpt -59.15 -39.84 83.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.062 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.0 mm -63.09 -43.02 98.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.858 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -56.4 -47.49 78.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.263 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -61.32 -44.36 97.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.107 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -60.02 -45.49 92.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.577 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.563 ' OD2' HD21 ' A' ' 77' ' ' LEU . 43.7 t0 -63.1 -37.83 88.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.655 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.0 -49.52 77.11 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.274 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.3 tp -59.44 -41.15 88.93 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.19 0.519 . . . . 0.0 110.163 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.56 -50.97 71.37 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.568 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.409 ' O ' ' HG ' ' A' ' 62' ' ' LEU . 70.5 t90 -57.82 -38.86 76.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.423 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -57.1 -45.77 83.13 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -60.59 -48.93 79.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.178 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.8 ' C ' HD12 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.03 -35.65 80.93 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.025 -0.67 . . . . 0.0 109.641 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.447 ' N ' ' HG ' ' A' ' 62' ' ' LEU . 29.3 tptp -61.26 -41.26 96.62 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 34.9 tp . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.734 179.194 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.816 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -66.2 -32.67 74.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.713 0.292 . . . . 0.0 110.343 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.63 -49.45 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.268 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -62.33 -44.0 97.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.359 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.31 90.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.452 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -62.6 -42.45 99.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.911 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.563 HD21 ' OD2' ' A' ' 55' ' ' ASP . 84.5 mt -62.85 -44.57 95.77 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.057 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.65 -47.36 91.57 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.266 0.555 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.603 ' O ' HG23 ' A' ' 83' ' ' VAL . 60.8 ttp180 -61.35 -40.89 95.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.049 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -60.7 -41.2 94.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.373 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -60.21 -47.43 85.98 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.253 0.549 . . . . 0.0 110.049 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 28.6 t-20 -67.42 -37.53 83.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.56 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 79' ' ' ARG . 43.5 t -62.43 -48.27 89.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.441 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -61.44 -48.33 89.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.536 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.99 -42.19 97.26 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.85 87.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.348 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.76 -47.29 85.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.497 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -76.12 -21.14 56.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.439 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.98 27.51 70.33 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 90' ' ' LEU . 41.6 mt . . . . . 0 C--N 1.33 -0.253 0 CA-C-O 120.662 0.267 . . . . 0.0 110.592 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.578 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.0 mp . . . . . 0 N--CA 1.457 -0.096 0 CA-C-O 120.825 0.345 . . . . 0.0 110.714 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.408 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 99.1 mt-10 -56.17 -31.34 63.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.071 0.462 . . . . 0.0 110.444 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.593 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 99.6 mttt -64.66 -48.12 75.95 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.533 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 120' ' ' LEU . 50.7 mt -71.42 -45.83 61.71 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.983 0.42 . . . . 0.0 111.889 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.579 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.4 t-105 -58.67 -48.69 80.23 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.408 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.0 m80 -69.87 -32.59 71.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.378 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 13.1 tptt -59.31 -48.55 81.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.733 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.98 -47.61 65.16 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.696 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -57.23 -49.51 75.79 Favored 'General case' 0 C--O 1.23 0.04 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.121 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 5.2 m -74.91 -46.43 36.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.74 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 41.7 p -45.85 -29.26 1.3 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.122 -178.273 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -155.72 -95.63 0.11 Allowed Glycine 0 N--CA 1.463 0.489 0 C-N-CA 119.928 -1.129 . . . . 0.0 111.173 179.351 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.597 ' O ' ' N ' ' A' ' 131' ' ' SER . 26.9 mttm -163.86 27.87 0.08 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.492 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.6 m-30 -63.5 44.58 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.651 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.597 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.5 p -100.95 112.4 24.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.436 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 124.98 -97.12 0.53 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.076 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 134' ' ' GLU . 12.7 pt-20 -78.17 -42.88 30.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.854 0.359 . . . . 0.0 110.841 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.492 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 53.0 mp0 -60.63 -53.56 55.98 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.948 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.579 HD22 ' CE3' ' A' ' 121' ' ' TRP . 2.8 mt -61.84 -41.18 97.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.175 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -60.0 -44.53 94.49 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.085 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -59.61 -43.84 93.62 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.0 mm? -59.31 -42.53 91.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.293 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.532 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -64.94 -37.82 88.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.42 -0.809 . . . . 0.0 113.027 176.336 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 94.5 mtt180 -52.37 -43.72 64.85 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.64 -40.1 76.72 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.776 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.532 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.2 m-85 -58.36 -55.22 37.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.33 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 59.9 mt -59.66 -38.48 81.57 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.22 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.428 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 2.7 m-70 -54.1 -47.66 71.53 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.848 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -61.71 -39.19 90.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -60.34 -41.98 94.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.26 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -65.01 -55.17 20.52 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.823 0.344 . . . . 0.0 111.297 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.43 -45.22 94.08 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.987 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.468 HG22 HD13 ' A' ' 197' ' ' ILE . 51.5 t -64.1 -35.5 73.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.949 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.789 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -66.1 -41.75 90.2 Favored 'General case' 0 C--O 1.209 -1.042 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.014 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.9 -43.65 98.24 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.091 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.49 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 17.1 m-85 -70.5 -46.45 63.67 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.544 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' ASN . . . . . 0.46 ' ND2' ' CG1' ' A' ' 149' ' ' VAL . 89.5 m-20 -67.55 -42.59 82.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.59 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 150' ' ' HIS . 76.2 t -61.54 -47.05 95.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.034 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 155' ' ' LEU . 46.5 mt . . . . . 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.62 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.893 0.378 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 8.1 mp -62.83 -42.64 99.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.691 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.505 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.1 mttm -67.97 -34.2 76.09 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.935 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.544 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.6 tt0 -67.69 -47.6 68.97 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.218 0.532 . . . . 0.0 111.362 -178.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.49 ' CE ' ' CD1' ' A' ' 152' ' ' TYR . 12.4 ptmt -73.28 -40.64 64.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.44 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.822 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.9 -40.29 75.72 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.818 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.544 ' HG3' ' O ' ' A' ' 192' ' ' GLU . 3.4 ppt_? -65.6 -37.56 86.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 89.6 p -62.67 -43.88 97.68 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.468 HD13 HG22 ' A' ' 149' ' ' VAL . 96.8 mt -65.86 -43.34 93.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.782 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -60.87 -40.93 94.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.361 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.58 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 74.5 mt-30 -63.08 -38.56 91.66 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.576 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.76 -43.89 98.6 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 204' ' ' LEU . 18.9 mt -64.39 -39.04 93.09 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.01 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -59.76 -39.96 86.57 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.498 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 6.4 tmm_? -63.1 -42.68 99.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.393 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 201' ' ' LEU . 43.6 mt -61.86 -40.62 96.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.396 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -61.44 -41.68 97.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.749 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.704 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.1 mtp180 -62.3 -40.84 97.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.365 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.609 ' O ' ' N ' ' A' ' 211' ' ' GLY . 43.0 t -63.52 -46.09 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.083 0.468 . . . . 0.0 110.313 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -69.84 -26.65 64.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.508 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 41.1 m170 -101.81 -14.49 17.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.147 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 206' ' ' ARG . 64.1 tp60 -132.27 -37.84 1.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.765 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.609 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.555 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 . . . . . 0 N--CA 1.464 0.259 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 221' ' ' PRO . 32.4 mm-40 -89.65 150.95 45.16 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.615 ' O ' ' HB3' ' A' ' 222' ' ' ARG . 51.1 Cg_exo -51.54 -155.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.771 2.314 . . . . 0.0 111.874 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 221' ' ' PRO . 41.5 ttm180 87.62 -102.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.71 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.552 HG13 ' N ' ' A' ' 224' ' ' ILE . 14.4 p -59.15 -44.95 92.89 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 110.636 -179.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.552 ' N ' HG13 ' A' ' 223' ' ' VAL . 4.1 mm -61.6 -41.14 89.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.075 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -60.98 -39.65 90.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.91 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 7.7 mt -59.71 -41.81 91.64 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.28 0.562 . . . . 0.0 109.769 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.55 ' CZ3' HD13 ' A' ' 224' ' ' ILE . 54.8 m0 -61.42 -43.04 99.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.916 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.56 -25.52 65.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 232' ' ' SER . 2.8 mt -65.39 -43.33 91.02 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.93 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.438 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -34.8 -44.22 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.794 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -62.6 -47.91 81.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.652 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.547 ' O ' ' O ' ' A' ' 233' ' ' ALA . 35.7 t -67.6 -40.02 84.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.565 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 233' ' ' ALA . . . . . 0.547 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -47.93 -111.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.732 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -157.43 111.72 2.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 78.2 mt -146.36 161.64 39.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.579 ' OG1' ' HG2' ' A' ' 239' ' ' GLU . 0.0 OUTLIER -83.1 165.43 19.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.686 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -60.65 -47.38 86.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.991 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.1 -47.43 85.31 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 110.552 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 239' ' ' GLU . . . . . 0.579 ' HG2' ' OG1' ' A' ' 236' ' ' THR . 5.7 mm-40 -66.3 -35.77 81.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.002 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.798 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.11 -43.31 98.79 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.206 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -63.01 -48.99 76.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.398 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.69 -44.18 97.43 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.344 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.474 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -62.41 -43.87 97.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.122 179.062 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -59.37 -46.69 87.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.047 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -66.19 -44.07 85.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.706 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -59.66 -49.59 77.14 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.597 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.6 mm? -62.65 -38.32 89.84 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.525 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.41 -41.14 84.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.829 0.347 . . . . 0.0 110.071 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -66.51 -61.01 2.21 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.555 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 250' ' ' PHE . . . . . 0.434 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 25.3 t80 -59.58 -45.76 90.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.511 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.6 tp10 -54.88 -38.51 67.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.163 0.506 . . . . 0.0 109.701 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.31 82.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.244 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -60.72 -47.94 84.03 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.857 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.469 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 2.6 tp -63.49 -37.39 79.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.126 179.237 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -59.66 -44.02 93.72 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 121.07 0.462 . . . . 0.0 109.888 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -63.27 -42.41 99.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.134 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 257' ' ' HIS . . . . . 0.495 ' NE2' HG22 ' A' ' 297' ' ' THR . 15.5 t-80 -56.93 -42.43 80.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.159 0.504 . . . . 0.0 110.127 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -63.24 -40.0 96.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.084 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 259' ' ' HIS . . . . . 0.456 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -58.35 -46.58 86.0 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.147 0.499 . . . . 0.0 110.338 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -62.98 -35.68 80.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.201 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 261' ' ' GLN . . . . . 0.408 HE21 ' HB3' ' A' ' 261' ' ' GLN . 2.6 mm100 -60.48 -45.02 95.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.117 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -62.05 -43.76 98.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.209 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 263' ' ' GLN . . . . . 0.456 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.8 mp0 -66.92 -37.86 85.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.203 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 264' ' ' LEU . . . . . 0.891 HD21 ' OE1' ' A' ' 294' ' ' GLU . 53.9 tp -62.39 -43.54 98.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.294 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -66.21 -45.39 80.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.429 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 51.8 mt -62.94 -43.22 98.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.243 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.68 -37.82 82.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.253 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.77 -45.49 86.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.446 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -62.81 -46.44 87.96 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.618 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 60.5 tptt -60.48 -42.08 95.52 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.658 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.644 HD13 ' CB ' ' A' ' 286' ' ' SER . 35.4 tp -61.78 -43.15 99.43 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.27 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -58.13 -42.81 86.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.176 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -73.56 -33.71 64.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.506 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.744 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -64.04 -40.78 97.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.656 -179.673 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -54.26 -18.9 4.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.892 0.377 . . . . 0.0 110.594 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 4.1 t -62.32 -32.86 73.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.636 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.744 HG12 ' O ' ' A' ' 274' ' ' ALA . 10.4 p -58.67 -45.16 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.421 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.585 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 79.0 -10.26 34.42 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 279' ' ' ASP . . . . . 0.547 ' H ' HG13 ' A' ' 277' ' ' VAL . 54.1 m-20 -61.78 -38.6 88.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.661 0.267 . . . . 0.0 110.549 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 280' ' ' GLY . . . . . 0.661 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 98.11 -146.49 18.22 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 281' ' ' GLU . . . . . 0.458 ' OE1' ' C ' ' A' ' 280' ' ' GLY . 51.5 mp0 57.97 -65.03 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 110.778 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 282' ' ' ARG . . . . . 0.661 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -63.33 -37.97 89.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.665 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.81 -46.74 95.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.518 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 284' ' ' SER . . . . . 0.451 ' O ' ' OE1' ' A' ' 288' ' ' GLU . 12.0 t -63.1 -47.44 82.84 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.052 0.454 . . . . 0.0 110.933 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 73.3 ttp85 -64.11 -42.99 96.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.82 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 286' ' ' SER . . . . . 0.644 ' CB ' HD13 ' A' ' 271' ' ' LEU . 42.1 t -60.28 -43.79 95.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.453 -179.705 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 287' ' ' ARG . . . . . 0.636 ' NH2' ' CG ' ' A' ' 290' ' ' HIS . 5.5 mmp_? -64.12 -37.74 88.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.06 0.457 . . . . 0.0 110.677 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 288' ' ' GLU . . . . . 0.451 ' OE1' ' O ' ' A' ' 284' ' ' SER . 0.4 OUTLIER -60.22 -56.38 22.21 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.324 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.447 ' HD3' HD23 ' A' ' 292' ' ' LEU . 28.3 mmtt -65.57 -34.94 79.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.979 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 290' ' ' HIS . . . . . 0.636 ' CG ' ' NH2' ' A' ' 287' ' ' ARG . 42.8 t-80 -51.84 -48.68 63.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.66 -37.01 79.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.541 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.447 HD23 ' HD3' ' A' ' 289' ' ' LYS . 14.6 tp -62.2 -49.93 73.79 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.555 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 293' ' ' LEU . . . . . 0.463 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.4 mp -62.91 -41.33 99.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.134 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.891 ' OE1' HD21 ' A' ' 264' ' ' LEU . 29.5 tp10 -62.99 -41.25 99.52 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -59.51 -48.22 87.08 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.15 -40.23 89.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 0.0 110.231 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.495 HG22 ' NE2' ' A' ' 257' ' ' HIS . 0.2 OUTLIER -56.84 -47.48 80.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.105 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -63.12 -42.41 99.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.452 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.73 -47.55 76.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.479 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 300' ' ' LEU . . . . . 0.422 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.5 OUTLIER -60.24 -43.44 96.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.512 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.82 -42.02 84.8 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 302' ' ' TYR . . . . . 0.602 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 53.5 t80 -62.66 -46.62 87.34 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.422 0.629 . . . . 0.0 110.587 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 303' ' ' THR . . . . . 0.417 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 15.7 m -61.69 -45.93 91.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.454 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.51 -30.74 50.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.203 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -62.6 -55.04 30.87 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 121.141 0.496 . . . . 0.0 110.516 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 306' ' ' LYS . . . . . 0.602 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 77.5 mttt -62.17 -42.67 99.49 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.81 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.417 ' ND1' ' O ' ' A' ' 303' ' ' THR . 60.2 m80 -63.9 -32.01 73.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.988 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.425 HD23 ' CH2' ' A' ' 227' ' ' TRP . 1.6 mt -62.75 -48.44 79.19 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -66.84 -41.1 87.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.697 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -62.08 -49.12 77.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.793 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.453 ' HA ' HD23 ' A' ' 311' ' ' LEU . 26.6 mt -63.51 -40.58 97.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.029 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 6.7 t -60.02 -44.31 94.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.29 -44.86 84.31 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 314' ' ' ARG . . . . . 0.705 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -65.84 -43.61 87.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.877 0.37 . . . . 0.0 111.114 -179.599 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.3 mm -69.76 -24.02 26.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 67.7 m -59.14 -43.13 92.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.204 0.526 . . . . 0.0 110.057 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.251 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.755 0.312 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -61.19 -40.34 93.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 88.8 mmm -121.25 149.08 43.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.418 0.627 . . . . 0.0 111.074 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 23' ' ' GLU . 4.2 pm0 -61.58 -40.33 94.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.435 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -52.31 -48.79 65.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.179 0.514 . . . . 0.0 110.668 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.81 -39.47 91.87 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.359 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.9 t-20 -62.91 -38.82 92.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.189 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -61.74 -43.52 98.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.354 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.29 -42.68 99.06 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -61.16 -47.14 87.56 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.234 0.54 . . . . 0.0 110.44 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -57.51 -41.99 81.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -61.23 -43.1 99.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.238 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.87 88.11 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.071 0.462 . . . . 0.0 110.082 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.446 ' O ' ' ND1' ' A' ' 36' ' ' HIS . 24.5 mt-30 -59.41 -39.31 83.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.173 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.567 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 61.6 ttt85 -60.96 -39.88 91.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.373 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.67 -34.53 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.296 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.567 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 66.4 m-70 66.41 118.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.5 mt -137.13 154.61 75.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.115 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 79.4 Cg_exo -41.74 154.62 0.09 OUTLIER 'Trans proline' 0 C--N 1.312 -1.354 0 C-N-CA 122.504 2.136 . . . . 0.0 112.41 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 34.1 Cg_exo -56.5 -47.49 23.69 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.511 2.141 . . . . 0.0 112.375 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.8 -45.71 94.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.447 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpt180 -62.52 -41.89 99.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.58 -43.61 98.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.715 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.26 89.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.595 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -68.67 -42.38 77.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.528 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.729 HD13 ' OH ' ' A' ' 88' ' ' TYR . 50.9 tp -63.04 -48.67 77.74 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.23 0.538 . . . . 0.0 110.661 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -59.96 -42.77 94.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.25 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.615 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.33 -46.56 88.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.607 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -55.8 -47.78 76.53 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.485 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.0 -40.74 85.82 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.139 0.495 . . . . 0.0 109.988 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.49 -39.14 82.77 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.947 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 47' ' ' ALA . 35.9 mm -62.83 -42.71 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.59 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -55.79 -46.79 77.89 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.444 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -60.06 -50.48 73.56 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.355 0.597 . . . . 0.0 110.419 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.313 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -61.21 -40.57 94.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.385 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.18 -51.02 67.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.05 -39.65 93.09 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.242 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.5 92.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.63 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.459 ' CZ3' ' HD3' ' A' ' 63' ' ' LYS . 89.3 t90 -61.87 -40.26 94.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.267 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.76 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 87.8 tttt -57.61 -49.33 76.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.463 0.649 . . . . 0.0 109.556 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -66.46 -41.27 89.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.182 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.46 -44.16 97.59 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.618 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.76 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 18.4 pttm -61.93 -39.19 91.19 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 63' ' ' LYS . 56.5 tp . . . . . 0 CA--C 1.522 -0.117 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.509 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.619 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -60.61 -35.03 75.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.796 0.331 . . . . 0.0 110.361 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -62.07 -48.32 80.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.23 0.538 . . . . 0.0 110.003 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.37 -39.32 90.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.252 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.41 94.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.208 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -63.66 -39.74 95.1 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.466 -0.493 . . . . 0.0 109.754 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.7 mt -62.62 -45.23 93.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.431 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.24 -44.58 95.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.056 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.755 ' O ' HG23 ' A' ' 83' ' ' VAL . 63.3 ttm-85 -58.1 -42.63 86.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.885 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.428 ' O ' HG13 ' A' ' 84' ' ' ILE . 75.2 m-20 -62.72 -39.62 94.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.308 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -57.78 -49.63 75.96 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.96 -179.359 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.446 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 53.9 t-20 -64.68 -37.37 87.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.336 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 79' ' ' ARG . 72.7 t -63.16 -45.8 97.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.466 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.17 -50.34 80.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.061 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.438 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.6 mm? -65.44 -39.77 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.769 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.84 -45.23 95.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.65 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -62.83 -45.87 90.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.849 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.729 ' OH ' HD13 ' A' ' 45' ' ' LEU . 8.7 m-85 -64.44 -28.04 69.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.297 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.18 23.29 61.45 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.7 mt . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.8 0.333 . . . . 0.0 110.398 179.851 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.1 mt . . . . . 0 C--O 1.238 0.465 0 CA-C-O 121.234 0.54 . . . . 0.0 110.664 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.81 -33.18 70.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.333 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 56.6 mttp -60.8 -47.97 83.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.712 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.19 -45.82 86.65 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.206 0.527 . . . . 0.0 111.928 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.487 ' CE3' HD22 ' A' ' 135' ' ' LEU . 14.3 t-105 -60.86 -51.5 69.05 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.975 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -68.88 -29.32 67.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.234 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.634 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.1 tptt -57.6 -49.97 74.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.452 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.404 ' HB1' ' CB ' ' A' ' 130' ' ' PHE . . . -71.68 -47.56 53.33 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 119.3 -0.96 . . . . 0.0 111.022 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.427 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 38.3 ttmt -53.21 -48.47 68.1 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.875 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 10.5 m -78.91 -43.28 25.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.897 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.585 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 18.0 m -44.73 -28.49 0.63 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -163.87 -96.03 0.11 Allowed Glycine 0 C--N 1.321 -0.259 0 C-N-CA 119.684 -1.246 . . . . 0.0 111.576 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.702 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -152.02 20.5 0.68 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.46 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 2.6 m-85 -59.53 41.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.613 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.798 ' HA ' HD12 ' A' ' 135' ' ' LEU . 5.5 p -103.0 114.46 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.976 0.417 . . . . 0.0 111.247 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.502 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 120.92 -96.88 0.61 Allowed Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.788 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.47 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 79.7 mm-40 -72.97 -43.77 61.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.909 0.385 . . . . 0.0 111.342 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 4.1 mp0 -65.52 -45.8 82.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.126 0.489 . . . . 0.0 110.165 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 131' ' ' SER . 1.7 mt -60.64 -41.9 95.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.898 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.502 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -63.01 -40.23 97.15 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.92 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -59.56 -44.36 93.3 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 121.273 0.558 . . . . 0.0 110.207 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.1 mm? -60.84 -42.52 97.94 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -30.67 70.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 176.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 136' ' ' ASP . 59.6 mmt-85 -59.02 -44.16 91.69 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.432 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -71.02 -39.44 72.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.859 179.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.27 -58.28 9.2 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.565 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 143' ' ' LEU . 93.9 mt -61.0 -39.29 89.12 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.218 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -55.25 -43.02 74.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.441 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.525 ' CD2' HG23 ' A' ' 197' ' ' ILE . 5.7 m80 -64.84 -38.23 90.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.075 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -59.64 -45.03 93.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.403 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -70.48 -51.74 26.91 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.739 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.442 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 14.5 mptt -62.54 -44.51 96.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.157 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.453 HG22 ' ND2' ' A' ' 153' ' ' ASN . 2.6 p -63.77 -35.95 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.501 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.776 ' O ' HG23 ' A' ' 154' ' ' VAL . 1.9 m170 -66.01 -43.23 88.32 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.665 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.99 -44.7 96.18 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.364 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.442 ' CD2' ' O ' ' A' ' 148' ' ' LYS . 31.4 m-85 -69.58 -46.76 65.61 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.904 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' ASN . . . . . 0.453 ' ND2' HG22 ' A' ' 149' ' ' VAL . 62.4 m-20 -65.59 -41.07 93.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.103 0.478 . . . . 0.0 110.527 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 150' ' ' HIS . 63.8 t -63.08 -43.92 99.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.674 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 44.7 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.561 179.64 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 193' ' ' LYS . 75.7 mm-40 . . . . . 0 CA--C 1.518 -0.268 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.543 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 21.1 mt -61.16 -41.62 97.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.932 0.396 . . . . 0.0 110.208 178.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.652 ' HA ' HD23 ' A' ' 194' ' ' LEU . 68.1 mttm -67.68 -35.92 79.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.815 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 79.8 mm-40 -67.06 -45.65 76.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.981 0.42 . . . . 0.0 111.492 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.543 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 4.5 ptmt -69.25 -36.54 77.25 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.936 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.826 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -62.53 -44.11 97.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.989 -179.521 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.533 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 16.0 ptm180 -65.78 -35.87 81.93 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.417 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.44 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 72.4 m -59.5 -40.56 87.43 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.525 HG23 ' CD2' ' A' ' 145' ' ' HIS . 96.6 mt -63.76 -42.98 97.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.399 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -58.84 -41.99 88.24 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -61.61 -38.54 88.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.33 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.55 -41.68 97.36 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.213 -1.155 . . . . 0.0 110.213 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 204' ' ' LEU . 20.4 mt -61.94 -40.14 94.5 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.672 178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -62.04 -36.53 81.87 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.464 ' HD3' ' O ' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -62.45 -42.49 99.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.248 178.832 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 201' ' ' LEU . 32.4 mt -60.19 -39.36 86.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.451 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -60.44 -41.8 94.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.604 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.603 ' O ' ' N ' ' A' ' 210' ' ' GLN . 25.9 mmt85 -62.43 -38.62 90.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.117 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.591 ' O ' ' N ' ' A' ' 211' ' ' GLY . 30.4 t -63.64 -45.09 98.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.302 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -66.13 -28.17 68.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.471 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -94.64 -39.45 10.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.026 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.603 ' N ' ' O ' ' A' ' 206' ' ' ARG . 56.2 tt0 -96.16 -40.46 9.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.399 . . . . 0.0 110.715 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.434 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.43 ' O ' ' O ' ' A' ' 220' ' ' GLU . 96.9 mt-10 . . . . . 0 N--CA 1.454 -0.247 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.623 ' C ' ' H ' ' A' ' 222' ' ' ARG . 7.3 mt-10 41.12 103.69 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.264 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.486 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 32.1 Cg_exo -57.97 15.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 123.023 2.482 . . . . 0.0 112.243 177.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.623 ' H ' ' C ' ' A' ' 220' ' ' GLU . 84.8 mtt85 -112.66 -59.81 1.96 Allowed 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.853 0.359 . . . . 0.0 110.692 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.899 HG13 ' H ' ' A' ' 224' ' ' ILE . 6.2 p -65.37 -64.61 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-O 121.404 0.621 . . . . 0.0 111.326 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.899 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -62.3 -32.39 54.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.721 -179.151 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 225' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 21.8 t70 -63.0 -40.74 98.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.303 0.573 . . . . 0.0 109.836 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.8 mt -61.42 -40.78 95.66 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.572 ' CH2' HD23 ' A' ' 308' ' ' LEU . 40.0 m0 -59.75 -38.28 81.33 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.059 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -63.22 -37.55 87.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.443 ' HA ' HD23 ' A' ' 229' ' ' LEU . 93.3 mt -63.96 -41.86 97.45 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.366 0.603 . . . . 0.0 110.199 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -50.03 -14.88 0.17 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.835 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.578 ' O ' HD21 ' A' ' 240' ' ' LEU . 18.3 pt20 -64.82 -42.83 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.759 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.5 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 23.7 m -136.95 58.03 1.74 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -109.28 45.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.403 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 234' ' ' ASN . . . . . 0.578 ' C ' HD22 ' A' ' 235' ' ' LEU . 50.2 t-20 65.84 53.38 1.15 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.998 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.578 HD22 ' C ' ' A' ' 234' ' ' ASN . 4.2 mm? -108.56 177.87 4.66 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.066 0.46 . . . . 0.0 110.447 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.477 ' OG1' ' CG ' ' A' ' 239' ' ' GLU . 60.6 p -84.57 -176.23 6.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.477 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -85.47 -50.78 7.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.202 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -62.01 -44.72 96.12 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.033 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 239' ' ' GLU . . . . . 0.477 ' CG ' ' OG1' ' A' ' 236' ' ' THR . 85.8 mt-10 -61.87 -34.28 75.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.578 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -64.77 -42.08 95.39 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.837 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -64.3 -49.09 73.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.512 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.42 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.126 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.3 -43.25 95.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.456 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -56.43 -51.28 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 110.381 -178.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -66.54 -39.95 88.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.744 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -58.89 -53.99 52.13 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.207 0.527 . . . . 0.0 110.447 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 247' ' ' LEU . 4.5 mm? -64.08 -33.81 76.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.444 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.716 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.9 tttt -57.28 -44.96 84.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.224 0.535 . . . . 0.0 110.072 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -68.96 -44.04 73.77 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.604 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -61.24 -47.2 87.15 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 120.991 0.424 . . . . 0.0 111.088 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.716 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.0 OUTLIER -61.28 -36.27 79.58 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.72 87.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.69 -48.16 80.5 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.233 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.401 HG22 ' H ' ' A' ' 254' ' ' ILE . 1.2 tt -65.02 -34.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.096 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -64.57 -44.73 89.8 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.34 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.82 -44.31 96.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.332 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -44.8 73.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -60.71 -40.76 93.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.29 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -59.78 -47.22 86.57 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.515 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -63.94 -34.52 78.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.397 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -61.8 -46.87 87.66 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.189 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.99 -46.76 87.83 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.05 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -64.38 -34.96 79.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.987 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 60.5 tp -62.62 -42.9 99.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -64.81 -44.66 89.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.712 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.42 -43.26 98.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.192 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.4 -38.6 87.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.099 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -61.54 -46.79 88.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.87 -49.12 78.93 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -61.89 -38.75 89.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.516 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.04 -43.06 99.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.261 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -60.27 -43.27 96.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.403 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -65.9 -39.88 91.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.29 -38.32 89.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.941 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -63.9 -30.37 71.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.517 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 6.4 t -59.39 -40.16 85.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.536 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 91.5 t -60.75 -45.31 97.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.495 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 86.35 18.72 58.45 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.03 -38.24 90.36 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.292 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 280' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 81.47 -164.76 45.73 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 63.27 -70.58 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.8 0.333 . . . . 0.0 110.619 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 282' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 280' ' ' GLY . 11.2 ptp85 -67.97 -24.56 65.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.825 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.9 -47.59 92.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.421 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 38.6 t -66.55 -44.86 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.18 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.03 -49.49 77.19 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.876 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 71.7 m -60.83 -43.96 97.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -63.63 -39.06 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.724 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -58.36 -57.18 14.02 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.95 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.686 ' HD3' HD23 ' A' ' 292' ' ' LEU . 17.1 mmtm -64.28 -36.49 84.27 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.077 179.159 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -49.23 -50.05 40.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.78 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.4 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.601 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.686 HD23 ' HD3' ' A' ' 289' ' ' LYS . 22.8 tp -59.98 -49.72 76.58 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.548 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.17 -42.07 99.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.014 0.435 . . . . 0.0 109.891 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.59 ' O ' ' OG1' ' A' ' 297' ' ' THR . 12.3 tm-20 -60.97 -40.12 92.2 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.04 -43.22 99.46 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.26 -43.95 98.04 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.227 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.59 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 25.3 p -57.36 -43.86 83.87 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.99 0.424 . . . . 0.0 110.121 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -62.79 -46.36 88.36 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.137 0.494 . . . . 0.0 110.681 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.52 -39.92 89.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.144 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.85 -43.86 98.0 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.152 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.72 -42.55 96.42 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -61.52 -44.89 96.25 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.137 0.494 . . . . 0.0 110.616 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.3 m -60.52 -43.93 96.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.352 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.8 t -59.81 -42.76 90.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.921 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.71 -50.51 72.97 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.031 0.443 . . . . 0.0 110.596 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -63.77 -41.18 98.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.682 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -66.23 -34.98 79.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.011 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.664 HD22 HG21 ' A' ' 223' ' ' VAL . 19.3 mt -62.14 -43.72 98.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.378 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -68.53 -43.87 75.83 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.737 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -64.15 -49.53 71.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.112 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 311' ' ' LEU . 28.1 mt -63.89 -41.32 97.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.9 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 74.7 m -59.64 -41.81 91.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.545 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -68.4 -47.47 57.49 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -66.1 -42.35 89.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.785 0.326 . . . . 0.0 111.269 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -70.23 -23.75 25.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.94 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.4 t -59.66 -43.84 93.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 109.735 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.732 179.392 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.63 ' N ' HD22 ' A' ' 26' ' ' ASN . 75.2 m-85 . . . . . 0 N--CA 1.462 0.131 0 CA-C-O 120.758 0.313 . . . . 0.0 110.898 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.489 ' C ' ' SD ' ' A' ' 22' ' ' MET . 85.5 mtp180 -92.38 -4.08 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.78 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.489 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -133.56 137.98 45.8 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.027 0.441 . . . . 0.0 111.109 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 16.6 pt-20 -65.12 -42.59 93.77 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' H ' ' HG2' ' A' ' 24' ' ' LYS . 13.2 pttm -57.0 -45.42 83.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.0 0.429 . . . . 0.0 109.963 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.1 mp -61.62 -41.51 97.58 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.63 HD22 ' N ' ' A' ' 20' ' ' PHE . 28.7 m120 -62.09 -38.75 90.03 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.199 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -59.01 -48.78 80.36 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.885 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.436 ' N ' HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -61.97 -42.14 98.79 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.116 179.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.645 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 61.1 t-105 -61.12 -45.06 96.23 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.072 0.463 . . . . 0.0 110.383 179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.439 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 81.3 tt0 -56.85 -46.04 82.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.372 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -61.71 -40.56 95.48 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.474 -0.491 . . . . 0.0 110.281 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.91 -43.9 86.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.645 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 88.2 mt-30 -62.81 -38.5 90.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.232 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.439 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -61.19 -41.66 97.21 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.376 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.17 -41.17 97.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.337 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.401 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.2 OUTLIER 65.33 104.83 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.764 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.522 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -125.47 158.51 64.2 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.354 179.614 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -39.12 153.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.478 0 C-N-CA 122.593 2.195 . . . . 0.0 112.417 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.5 -41.77 68.25 Favored 'Trans proline' 0 N--CA 1.499 1.837 0 C-N-CA 122.812 2.341 . . . . 0.0 112.538 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 70.6 t -62.69 -46.42 96.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -64.76 -38.52 91.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.335 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.25 -46.08 88.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.18 -42.67 83.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.866 0.365 . . . . 0.0 110.816 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -67.63 -45.27 75.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.564 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.52 HD13 ' OH ' ' A' ' 88' ' ' TYR . 59.3 tp -63.13 -48.89 76.57 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.523 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -60.3 -41.31 93.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.282 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.583 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.97 -50.41 74.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -57.65 -48.11 80.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.946 0.403 . . . . 0.0 110.996 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.71 -39.82 81.91 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.01 -40.46 89.34 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.882 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.583 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.6 mm -62.45 -43.84 98.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -58.42 -42.89 88.28 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.684 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.49 -49.56 77.05 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.155 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -63.0 -41.57 99.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.792 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 55' ' ' ASP . 48.5 t0 -63.34 -39.38 94.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.356 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.33 -46.38 90.51 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.848 0.356 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.6 tp -61.4 -43.52 98.73 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.722 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.411 ' O ' HD13 ' A' ' 62' ' ' LEU . . . -61.98 -44.5 96.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.696 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.3 t90 -56.33 -42.45 77.7 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.2 tttt -60.52 -45.92 92.03 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.688 -0.405 . . . . 0.0 109.977 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -60.47 -42.64 96.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.265 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 58' ' ' ALA . 10.3 mp -62.03 -40.64 96.4 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.341 -0.544 . . . . 0.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.96 -40.72 85.6 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.642 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.5 tt . . . . . 0 C--N 1.328 -0.332 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.76 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -66.81 -34.39 77.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.453 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.491 ' HD2' ' H ' ' A' ' 73' ' ' LYS . 2.7 mptp? -61.44 -68.09 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.074 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -51.74 -39.14 57.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.367 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.53 95.11 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.412 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.487 ' NH1' HD21 ' A' ' 80' ' ' ASN . 73.7 ttt-85 -62.62 -43.07 99.73 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.01 -43.37 98.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.573 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.58 -44.69 98.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.148 0.499 . . . . 0.0 109.95 179.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.553 ' O ' HG23 ' A' ' 83' ' ' VAL . 7.9 mmp_? -59.86 -41.74 92.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.236 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.487 HD21 ' NH1' ' A' ' 76' ' ' ARG . 92.1 m-20 -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.532 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.579 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.22 -49.19 78.79 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.753 -179.55 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.422 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 50.8 t-20 -64.21 -40.44 96.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.678 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 79' ' ' ARG . 55.6 t -62.0 -45.81 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.773 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.65 -48.85 86.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.318 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.5 -38.56 90.08 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.76 77.27 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.319 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.73 -46.1 83.67 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.288 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.52 ' OH ' HD13 ' A' ' 45' ' ' LEU . 12.8 m-85 -63.85 -27.7 69.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.946 0.403 . . . . 0.0 110.121 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.38 29.37 73.08 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.3 mt . . . . . 0 C--N 1.332 -0.157 0 CA-C-O 120.878 0.37 . . . . 0.0 110.798 -179.728 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 58.2 mt . . . . . 0 C--O 1.234 0.251 0 CA-C-O 120.882 0.372 . . . . 0.0 110.644 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 77.9 mt-10 -60.48 -25.2 65.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.937 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.49 -55.76 29.53 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.52 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 120' ' ' LEU . 32.1 mt -68.96 -42.33 76.76 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 112.112 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.64 ' CE3' HD22 ' A' ' 135' ' ' LEU . 7.5 t-105 -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.739 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.593 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.4 m-70 -68.0 -32.92 73.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.054 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.464 ' O ' ' CB ' ' A' ' 127' ' ' SER . 13.1 tptt -57.52 -49.56 75.93 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.96 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -69.15 -47.41 65.09 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.654 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.455 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 37.3 ttmt -54.6 -50.72 67.38 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.649 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 54.7 m -74.31 -41.9 60.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.932 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.3 t -48.62 -26.15 2.11 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 -178.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.67 -94.22 0.1 OUTLIER Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.041 -1.076 . . . . 0.0 111.515 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.4 pttm -162.83 30.97 0.1 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.515 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 6.5 m-85 -64.31 49.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.233 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.576 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.6 p -104.5 137.4 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.197 0.522 . . . . 0.0 111.767 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 95.45 -97.34 2.1 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-N 115.234 -0.893 . . . . 0.0 112.218 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 97.9 mt-10 -78.14 -43.91 27.49 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.8 0.333 . . . . 0.0 111.679 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 138' ' ' LEU . 48.2 mt-10 -60.61 -52.52 64.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.054 0.454 . . . . 0.0 110.197 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.64 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -62.05 -41.44 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.938 179.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -61.3 -37.97 85.15 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 56.1 mmtt -62.03 -42.41 99.15 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 134' ' ' GLU . 9.1 mp -59.73 -42.56 93.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.458 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -36.94 85.96 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.569 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 72.5 mtp85 -54.1 -42.13 69.06 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 118.588 -1.245 . . . . 0.0 108.149 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -69.23 -41.62 76.76 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.678 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -57.23 -57.57 12.02 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.583 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.56 -39.14 83.05 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.179 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.569 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 2.0 m-70 -54.61 -43.16 71.96 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.416 -0.514 . . . . 0.0 109.846 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.62 -39.13 88.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.574 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -59.75 -46.3 89.57 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.192 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 10.2 pt-20 -69.89 -44.82 68.97 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.419 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 86.1 mttt -62.92 -46.7 86.58 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.233 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.444 HG22 HD13 ' A' ' 197' ' ' ILE . 55.1 t -64.49 -44.27 96.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.397 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.733 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.4 m170 -60.87 -38.54 85.98 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.465 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -61.49 -44.75 96.53 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.992 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.557 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 31.3 m-85 -66.74 -49.67 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.381 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -65.66 -41.03 93.01 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.953 0.406 . . . . 0.0 111.164 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 150' ' ' HIS . 66.9 t -63.57 -44.54 98.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.727 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.2 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.511 179.373 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 . . . . . 0 C--O 1.23 0.07 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 3.4 mt -62.17 -39.79 93.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.156 179.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -66.64 -42.47 86.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.007 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -68.69 -35.79 77.66 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.567 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.557 ' HE3' ' CD1' ' A' ' 152' ' ' TYR . 26.9 mtpt -63.34 -46.95 84.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.696 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -72.24 -35.77 68.91 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.286 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.451 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 11.0 mmt85 -64.29 -41.36 96.91 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.626 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 69.8 m -65.47 -45.22 84.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.229 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.444 HD13 HG22 ' A' ' 149' ' ' VAL . 90.7 mt -66.33 -44.31 91.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.176 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -65.73 -40.83 92.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.029 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 195' ' ' ARG . 79.3 mt-30 -64.32 -36.68 84.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.23 178.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.98 -51.83 50.04 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 31.0 mt -64.29 -41.63 96.78 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.222 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -63.58 -36.6 84.34 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.71 ' HE ' HG21 ' A' ' 207' ' ' VAL . 0.0 OUTLIER -63.16 -44.16 96.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.72 179.101 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 33.3 mt -62.02 -39.03 90.91 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -61.93 -45.6 92.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.968 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.69 ' O ' ' N ' ' A' ' 210' ' ' GLN . 90.3 mmt-85 -65.76 -42.35 90.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.092 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.71 HG21 ' HE ' ' A' ' 203' ' ' ARG . 77.0 t -64.09 -45.36 96.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.061 0.457 . . . . 0.0 110.319 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -67.47 -28.85 68.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.659 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -101.21 -14.11 17.84 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.712 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.69 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.1 tt0 -140.15 -20.32 0.87 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.619 0.247 . . . . 0.0 111.361 -179.031 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.682 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 N--CA 1.461 0.339 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 220' ' ' GLU . 82.0 tt0 . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 219' ' ' GLU . 2.8 mt-10 55.36 153.59 0.06 OUTLIER Pre-proline 0 N--CA 1.472 0.64 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.675 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -83.12 81.79 2.28 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 122.201 1.934 . . . . 0.0 112.07 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -147.28 -98.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.968 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.552 HG13 ' N ' ' A' ' 224' ' ' ILE . 7.5 p -60.52 -46.04 96.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.659 0 CA-C-O 121.154 0.502 . . . . 0.0 110.801 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.754 HD11 ' CE1' ' A' ' 250' ' ' PHE . 0.7 OUTLIER -63.41 -35.64 73.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.818 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -62.09 -41.87 98.63 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.067 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 9.6 mt -59.39 -40.58 87.01 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.614 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 46.6 m0 -60.48 -43.98 96.39 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.04 178.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.624 HD23 ' OG ' ' A' ' 232' ' ' SER . 3.6 mt -68.9 -43.82 74.45 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.331 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -39.64 -37.68 0.53 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.396 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -70.17 -45.87 65.84 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.173 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.624 ' OG ' HD23 ' A' ' 229' ' ' LEU . 91.6 p -80.11 -6.88 58.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.394 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -67.26 -121.28 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.376 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 234' ' ' ASN . . . . . 0.521 ' C ' HD22 ' A' ' 235' ' ' LEU . 0.2 OUTLIER -163.38 69.58 0.22 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 110.544 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.546 ' N ' HD22 ' A' ' 235' ' ' LEU . 3.4 mm? -100.76 -171.91 2.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.711 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 10.9 p -82.97 163.15 21.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.699 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -63.79 -46.89 83.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.892 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.51 -43.13 95.06 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.556 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -63.74 -36.29 83.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.084 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.638 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -61.79 -45.31 94.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.384 -179.615 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -64.24 -47.49 79.46 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.89 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.56 -41.98 99.25 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.816 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.498 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.23 -43.95 93.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.437 178.904 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -47.5 85.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.211 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.91 -46.97 79.45 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.354 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -56.44 -53.13 61.0 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.292 0.568 . . . . 0.0 110.382 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.03 -40.3 97.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.573 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 64.1 tttp -50.47 -45.46 56.21 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.76 -41.83 91.6 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.221 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 250' ' ' PHE . . . . . 0.754 ' CE1' HD11 ' A' ' 224' ' ' ILE . 0.0 OUTLIER -58.64 -51.45 69.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.447 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.551 ' N ' ' CG ' ' A' ' 250' ' ' PHE . 11.6 pt-20 -59.59 -37.5 78.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.04 95.77 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.525 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.3 -46.22 87.73 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.41 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -64.64 -38.7 83.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -60.34 -44.91 95.09 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.515 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -61.63 -43.91 97.98 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 257' ' ' HIS . . . . . 0.532 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -55.95 -43.97 77.99 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.539 -0.464 . . . . 0.0 109.78 179.226 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 258' ' ' ASN . . . . . 0.532 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 39.9 t-20 -59.92 -41.16 91.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.237 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -59.0 -47.95 83.37 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.905 0.384 . . . . 0.0 110.296 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -61.8 -37.59 84.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.303 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -59.16 -43.84 92.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.307 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -61.61 -47.76 83.98 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.13 0.49 . . . . 0.0 110.041 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -64.27 -35.06 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.03 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 65.3 tp -62.04 -42.99 99.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.201 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.21 -46.2 88.11 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.456 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.13 -43.63 98.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.164 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.55 78.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.251 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 268' ' ' HIS . . . . . 0.53 ' NE2' ' NE ' ' A' ' 272' ' ' ARG . 24.7 t60 -64.05 -46.1 85.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.318 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.95 -46.15 91.86 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 110.389 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.47 -39.41 90.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.356 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.697 HD23 ' O ' ' A' ' 271' ' ' LEU . 2.6 tt -60.42 -44.59 95.61 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 272' ' ' ARG . . . . . 0.53 ' NE ' ' NE2' ' A' ' 268' ' ' HIS . 99.8 mtt180 -60.33 -44.17 95.75 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.21 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -67.77 -39.62 84.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.656 -0.417 . . . . 0.0 110.83 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.557 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -60.59 -36.81 79.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.007 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.61 -24.5 63.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 0.0 110.364 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 9.0 t -88.32 3.46 49.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.868 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.592 HG13 ' N ' ' A' ' 278' ' ' GLY . 11.3 p -61.11 -44.94 99.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.592 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 149.41 -98.44 0.19 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.72 -37.95 89.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.833 0.349 . . . . 0.0 110.164 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.14 46.75 8.93 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -68.72 -32.77 72.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.741 0.305 . . . . 0.0 110.755 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 282' ' ' ARG . . . . . 0.441 HH11 ' CB ' ' A' ' 274' ' ' ALA . 9.4 ptm180 -91.07 0.96 57.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.995 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 39.2 t -61.49 -46.33 96.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.7 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.5 t -61.74 -44.78 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.139 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 53.1 ttt85 -62.68 -46.8 86.48 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.952 0.406 . . . . 0.0 110.924 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.1 t -63.22 -45.07 93.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -63.9 -39.79 94.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -58.76 -59.58 5.2 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.019 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.602 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.7 mmtp -64.02 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.866 -0.734 . . . . 0.0 110.044 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -46.19 -54.65 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.897 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.34 82.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.714 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.602 HD23 ' HD3' ' A' ' 289' ' ' LYS . 18.5 tp -59.77 -49.92 75.85 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.809 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.65 -42.0 98.16 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.38 0.61 . . . . 0.0 109.827 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.484 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.9 tt0 -62.91 -36.62 83.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.802 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.96 -42.86 98.13 Favored Glycine 0 CA--C 1.522 0.492 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.2 tpp85 -60.33 -44.47 95.47 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.08 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 35.2 p -58.87 -46.76 87.01 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.436 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -62.5 -45.07 94.7 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.05 0.453 . . . . 0.0 110.338 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -59.5 -39.99 85.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.71 -43.01 99.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.17 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.22 -42.15 97.09 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 302' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 61.5 t80 -61.93 -45.53 93.28 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.389 0.614 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 9.8 m -59.75 -42.58 93.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.763 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.74 -42.91 90.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -54.9 -52.17 63.75 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.571 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 306' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 50.1 mttt -62.46 -40.5 96.82 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.93 -0.708 . . . . 0.0 110.996 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -64.46 -36.32 83.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.188 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.614 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 12.4 mt -62.51 -43.74 98.08 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.448 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -66.94 -44.72 79.91 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.672 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -64.41 -48.55 74.97 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.405 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.459 HD12 ' CH2' ' A' ' 227' ' ' TRP . 31.8 mt -63.29 -41.73 99.01 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.523 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 11.5 t -61.0 -43.33 99.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.446 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.21 -51.8 52.23 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 120.931 -0.652 . . . . 0.0 111.682 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -67.2 -41.85 85.12 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.218 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 5.0 mm -63.76 -41.73 93.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.1 p -58.88 -41.22 86.61 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.502 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.4 tpp180 . . . . . 0 N--CA 1.449 -0.523 0 C-N-CA 117.814 -1.555 . . . . 0.0 108.146 176.81 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 . . . . . 0 N--CA 1.462 0.156 0 CA-C-O 120.685 0.279 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.679 ' NH2' ' OE2' ' A' ' 53' ' ' GLU . 89.3 mtm-85 -95.85 12.37 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.018 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.448 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 1.2 mpt? -138.03 141.39 40.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.035 0.445 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 20.2 pt-20 -65.48 -43.72 89.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.424 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 14.0 pttm -55.66 -44.62 77.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.2 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 22' ' ' MET . 95.7 mt -62.85 -42.38 99.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.025 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -62.93 -41.69 99.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.377 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -60.02 -45.42 92.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.572 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 28' ' ' LEU . 92.4 mt -61.89 -42.57 99.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.254 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 27.7 t-105 -62.58 -45.96 90.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.384 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -57.54 -43.49 84.45 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.252 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.24 -43.05 99.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.591 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.09 80.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.942 0.401 . . . . 0.0 110.342 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.432 ' O ' ' ND1' ' A' ' 36' ' ' HIS . 76.3 mt-30 -61.65 -38.66 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.349 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.459 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 60.1 ttm-85 -60.57 -42.16 96.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.384 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.0 mt -69.55 -30.15 67.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.732 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.459 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 68.0 m-70 65.99 118.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.743 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -138.07 154.46 74.21 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.859 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.31 154.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 122.718 2.279 . . . . 0.0 112.364 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.67 -48.7 0.38 Allowed 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.617 2.211 . . . . 0.0 112.403 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.543 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 71.7 t -61.67 -48.65 87.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.435 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.7 ttp85 -65.04 -41.67 94.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.402 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.47 -42.4 99.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.619 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.82 88.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.414 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.543 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 3.7 mp0 -67.91 -41.22 83.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.652 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.7 tp -61.84 -48.33 81.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.154 0.502 . . . . 0.0 110.622 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.2 -41.44 96.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.604 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -57.92 -48.61 79.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.603 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -55.75 -48.97 74.34 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.94 0.4 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.9 mt -58.25 -39.78 80.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.153 0.501 . . . . 0.0 109.833 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.81 -38.42 85.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.604 HG12 ' O ' ' A' ' 47' ' ' ALA . 37.2 mm -62.3 -42.57 95.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.671 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -57.38 -50.85 71.67 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.471 179.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.679 ' OE2' ' NH2' ' A' ' 21' ' ' ARG . 82.2 tt0 -55.24 -49.25 72.49 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.444 0.64 . . . . 0.0 110.296 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -60.73 -42.74 97.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.314 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -62.02 -38.24 87.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.4 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.45 -49.23 76.93 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.89 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 14.8 mt -61.32 -42.25 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.456 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -41.78 97.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.49 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -60.67 -41.42 95.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.291 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -58.88 -46.01 88.84 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -59.53 -43.29 93.5 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.85 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.05 -37.51 87.47 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.009 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -57.55 -45.6 84.92 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.867 179.142 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.527 0.805 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -70.28 -35.27 73.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.856 0.36 . . . . 0.0 110.332 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -64.75 -52.28 57.81 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.129 0.49 . . . . 0.0 110.583 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 22.4 pt-20 -62.65 -38.94 92.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.979 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.47 -42.31 91.73 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.323 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.8 ttt-85 -63.64 -43.52 96.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -63.73 -42.98 97.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.366 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.82 -44.47 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.192 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.604 ' O ' HG23 ' A' ' 83' ' ' VAL . 3.3 mmp_? -59.83 -42.03 92.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.256 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 84' ' ' ILE . 92.6 m-20 -63.57 -39.85 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.294 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.637 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.83 -48.15 82.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.277 0.561 . . . . 0.0 110.171 -179.491 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.77 -38.16 88.3 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.412 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 79' ' ' ARG . 53.6 t -63.71 -46.24 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.424 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.9 mt -59.67 -51.32 74.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.473 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.31 -42.47 92.99 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.062 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.51 99.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.809 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -62.83 -49.22 75.76 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.564 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -67.6 -27.76 67.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.032 179.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 72.97 25.51 73.53 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 90' ' ' LEU . 50.0 mt . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.248 . . . . 0.0 110.75 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.235 0.339 0 CA-C-O 121.013 0.435 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -61.6 -39.41 91.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.573 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.6 mtmt -61.06 -42.4 98.42 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.409 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.49 -48.02 79.37 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.273 0.559 . . . . 0.0 111.88 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.558 ' CE3' HD22 ' A' ' 135' ' ' LEU . 19.1 t-105 -61.98 -48.42 80.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.426 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 3.2 m80 -69.26 -29.92 67.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.335 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.626 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.5 tptt -58.58 -52.01 67.48 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.894 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.26 -46.46 49.82 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.433 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 46.4 tttt -52.0 -47.43 64.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.669 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.2 m -82.87 -43.98 15.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.863 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.567 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 20.6 m -44.53 -28.92 0.64 Allowed 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.155 -178.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -158.29 -96.84 0.12 Allowed Glycine 0 N--CA 1.46 0.284 0 C-N-CA 119.626 -1.273 . . . . 0.0 111.356 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.63 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.7 mttt -155.98 21.3 0.38 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.796 ' HA ' ' HG3' ' A' ' 134' ' ' GLU . 2.9 m-85 -62.45 49.44 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.907 -178.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.63 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.0 OUTLIER -112.39 110.77 21.17 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.378 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 133.31 -98.8 0.35 Allowed Glycine 0 CA--C 1.53 0.988 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.816 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.2 mm-40 -81.85 -44.05 17.41 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.495 -0.415 . . . . 0.0 111.31 -179.024 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.948 ' CD ' ' H ' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -63.73 -46.11 86.85 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.558 HD22 ' CE3' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -62.44 -41.9 99.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.097 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -62.98 -37.1 85.79 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.468 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 59.3 mttp -61.69 -43.11 99.49 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.324 0.583 . . . . 0.0 109.839 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 134' ' ' GLU . 2.7 mm? -59.47 -43.68 93.18 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.95 -37.38 87.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.619 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -51.38 -42.07 61.12 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.584 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 6.0 mp0 -68.55 -45.47 72.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.374 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -56.6 -52.74 63.69 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.357 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.59 -39.94 89.94 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.238 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -55.5 -40.87 72.29 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.481 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.412 ' CE1' HG23 ' A' ' 197' ' ' ILE . 4.2 m-70 -64.97 -41.72 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.786 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -60.19 -48.89 79.81 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.763 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 18.5 pt-20 -70.93 -46.28 62.73 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.512 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 68.1 mttm -61.57 -43.2 99.3 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.542 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 43.4 t -64.65 -43.84 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.731 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.752 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -62.7 -36.18 82.13 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.452 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 147' ' ' GLU . 79.4 mm-40 -65.04 -48.04 75.25 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.55 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -67.96 -42.17 81.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.933 0.397 . . . . 0.0 110.432 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 58.3 m-20 -69.45 -45.87 68.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.015 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.752 HG23 ' O ' ' A' ' 150' ' ' HIS . 71.6 t -62.71 -46.47 96.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.064 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 26.3 mt . . . . . 0 C--N 1.327 -0.41 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.575 179.645 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 . . . . . 0 CA--C 1.52 -0.208 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 10.6 mp -62.27 -45.08 94.87 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.597 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.487 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.11 -39.16 82.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.094 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 5.2 tm-20 -67.97 -46.05 72.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.084 0.469 . . . . 0.0 111.638 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 17.6 pttt -74.6 -44.5 50.39 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.325 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.695 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -67.15 -41.01 86.77 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.939 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.541 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -67.27 -35.58 79.79 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.62 ' O ' ' HG3' ' A' ' 199' ' ' GLN . 73.8 m -62.25 -40.74 97.18 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.412 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.5 mt -66.7 -44.26 89.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.357 0.599 . . . . 0.0 109.723 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 46.9 m-20 -64.18 -47.46 79.74 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.436 0.636 . . . . 0.0 110.389 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.62 ' HG3' ' O ' ' A' ' 196' ' ' SER . 0.0 OUTLIER -64.58 -29.62 70.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.052 179.514 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -64.6 -43.56 96.29 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 201' ' ' LEU . 28.2 mt -63.6 -41.88 98.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.045 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.523 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.23 -36.21 83.35 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.368 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.4 -41.86 99.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.508 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.9 mt -61.43 -40.54 94.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.294 179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -63.45 -41.13 98.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.959 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.719 ' O ' ' N ' ' A' ' 210' ' ' GLN . 78.9 mtp85 -64.13 -38.94 92.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.288 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.588 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -64.17 -43.11 97.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.024 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.0 p -62.97 -37.31 86.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.683 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 24.1 m170 -94.61 -38.46 10.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.379 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.719 ' N ' ' O ' ' A' ' 206' ' ' ARG . 39.6 tt0 -93.89 -32.97 13.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.739 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.588 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.438 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 . . . . . 0 CA--C 1.53 0.185 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 221' ' ' PRO . 0.5 OUTLIER -59.31 178.67 0.22 Allowed Pre-proline 0 N--CA 1.466 0.353 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.619 -179.315 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 220' ' ' GLU . 59.3 Cg_endo -84.11 88.42 1.06 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.597 2.198 . . . . 0.0 112.801 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -141.25 -105.65 0.15 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.441 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.553 HG13 ' N ' ' A' ' 224' ' ' ILE . 14.9 p -61.74 -46.6 96.17 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 CA-C-O 121.79 0.805 . . . . 0.0 110.046 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.553 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.2 OUTLIER -61.56 -32.86 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.672 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 225' ' ' ASP . . . . . 0.551 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 56.1 t0 -64.25 -40.56 96.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.541 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.6 tp -56.04 -42.42 76.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.456 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 27.5 m0 -62.65 -33.92 76.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.736 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 228' ' ' ASP . . . . . 0.65 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 92.7 m-20 -59.31 -39.12 82.06 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.623 ' N ' HD22 ' A' ' 229' ' ' LEU . 4.1 mm? -65.67 -40.27 92.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.725 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.597 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -25.42 -66.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.301 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.65 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 0.3 OUTLIER -25.48 -87.48 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.726 179.862 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 58.9 m -79.26 45.95 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.738 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 233' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -139.51 81.59 1.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.835 0.35 . . . . 0.0 110.54 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 60.38 59.54 2.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.374 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.597 HD12 ' O ' ' A' ' 230' ' ' ALA . 76.8 mt -141.13 157.57 45.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.997 0.427 . . . . 0.0 110.783 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 74.8 p -83.34 -162.35 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.674 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 237' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 34.9 p-10 -91.75 -53.72 4.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.101 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 63.8 mttp -61.02 -45.59 94.18 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.25 0.547 . . . . 0.0 110.689 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -62.16 -27.17 68.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.556 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.1 OUTLIER -64.26 -46.1 85.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.589 -179.371 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -66.99 -44.05 81.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.363 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -57.96 -51.1 71.06 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.337 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.456 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.97 -45.02 95.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.51 179.424 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.4 ttt-85 -51.85 -57.53 9.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.403 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -62.08 -35.54 78.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.675 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.23 -53.02 63.02 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.23 0.538 . . . . 0.0 110.445 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.2 mm? -63.21 -41.42 99.14 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.728 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.56 -37.63 78.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.386 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -65.48 -65.01 0.73 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.493 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 250' ' ' PHE . . . . . 0.565 ' CE2' ' CE1' ' A' ' 307' ' ' HIS . 76.2 m-85 -60.46 -40.75 92.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.701 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.542 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.9 tp10 -57.9 -42.04 83.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.285 0.564 . . . . 0.0 109.883 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.33 -35.75 80.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.236 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -60.88 -47.63 85.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.834 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.46 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.2 tt -65.36 -38.13 81.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.174 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.79 -48.36 80.99 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 121.213 0.53 . . . . 0.0 110.468 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.03 -41.46 99.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.065 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 257' ' ' HIS . . . . . 0.523 ' NE2' ' CD ' ' A' ' 261' ' ' GLN . 0.0 OUTLIER -56.71 -46.16 81.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.955 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 258' ' ' ASN . . . . . 0.501 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 49.7 t30 -60.13 -40.99 91.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.24 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 259' ' ' HIS . . . . . 0.457 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -57.66 -45.08 86.02 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.258 0.552 . . . . 0.0 109.859 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.02 -37.01 85.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.292 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 261' ' ' GLN . . . . . 0.523 ' CD ' ' NE2' ' A' ' 257' ' ' HIS . 82.2 mt-30 -58.23 -44.17 88.12 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.205 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.63 -47.25 86.25 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.115 0.483 . . . . 0.0 109.811 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 263' ' ' GLN . . . . . 0.457 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 5.5 mp0 -65.33 -31.89 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.021 179.377 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.04 -42.52 99.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.108 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 -65.99 -49.02 69.29 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.142 0.496 . . . . 0.0 110.474 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.62 -43.32 98.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.09 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.25 81.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.083 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -61.14 -48.41 81.76 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.25 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.93 -45.07 95.32 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.132 0.491 . . . . 0.0 110.398 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.15 -39.73 91.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.398 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.35 -43.75 96.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.037 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -60.31 -43.5 96.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.079 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -67.88 -40.76 83.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.826 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.33 86.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.948 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -55.84 -22.62 26.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.455 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 17.2 m -61.83 -39.06 90.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.65 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 77.9 t -60.85 -45.47 98.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.605 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 108.84 -6.79 33.14 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 279' ' ' ASP . . . . . 0.555 ' O ' HG23 ' A' ' 283' ' ' VAL . 91.4 m-20 -55.34 99.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.81 0.338 . . . . 0.0 110.496 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.7 -40.24 95.71 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.41 -46.32 89.14 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.729 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -68.94 -41.9 77.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.808 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 283' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 279' ' ' ASP . 54.6 t -64.35 -45.28 96.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 32.4 m -60.69 -45.86 92.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.058 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.86 -43.82 87.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.537 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 42.3 t -62.42 -43.66 98.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.585 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -64.26 -40.21 95.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.694 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -60.53 -51.49 69.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.162 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -66.02 -34.24 77.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.105 179.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -57.39 -52.05 66.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.601 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.67 -38.41 83.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.676 ' O ' HD12 ' A' ' 292' ' ' LEU . 2.2 tp -61.64 -46.91 87.76 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.237 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 293' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 297' ' ' THR . 41.9 tp -64.22 -42.85 96.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.202 0.525 . . . . 0.0 110.102 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.519 ' O ' ' OG1' ' A' ' 297' ' ' THR . 2.3 tm-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.79 -42.47 99.75 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -60.76 -43.54 97.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.473 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.519 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 76.7 p -58.97 -47.18 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.076 0.465 . . . . 0.0 110.358 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -62.35 -44.39 96.58 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.488 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -62.43 -37.5 86.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.022 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -44.18 97.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.983 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.51 96.28 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 302' ' ' TYR . . . . . 0.524 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 51.0 t80 -60.82 -45.83 92.93 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.245 0.545 . . . . 0.0 110.372 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.1 m -61.37 -44.75 96.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.461 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.96 -42.24 88.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.112 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.82 -54.92 40.89 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.058 0.456 . . . . 0.0 110.663 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 306' ' ' LYS . . . . . 0.524 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 75.4 mttt -61.22 -41.35 96.71 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.19 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.565 ' CE1' ' CE2' ' A' ' 250' ' ' PHE . 2.6 t-80 -64.76 -31.17 72.27 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.26 -48.35 81.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.178 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.62 -42.47 86.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.712 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.9 -47.21 85.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.47 HD11 ' CE1' ' A' ' 307' ' ' HIS . 26.8 mt -64.12 -40.51 96.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.74 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.1 t -59.7 -44.68 93.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.11 61.8 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -62.43 -45.6 92.37 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -70.34 -40.52 77.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.133 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.8 t -44.37 -48.08 9.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.055 0.455 . . . . 0.0 110.156 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 12.5 ptp85 . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.036 -178.037 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 . . . . . 0 N--CA 1.465 0.293 0 CA-C-O 120.755 0.312 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -89.61 10.99 21.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.971 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.3 mmm -142.89 141.39 31.51 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 111.062 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -63.86 -35.6 81.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.39 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -59.69 -47.96 83.56 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.017 0.437 . . . . 0.0 110.458 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.65 -37.88 88.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.47 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.43 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 48.9 t-20 -63.32 -40.72 98.12 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.347 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.61 -44.27 96.73 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.604 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.91 -42.61 99.29 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.049 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -61.56 -43.66 98.45 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.222 0.534 . . . . 0.0 110.459 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -58.4 -44.52 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.047 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.52 -41.32 97.15 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.523 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.97 87.24 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.055 0.455 . . . . 0.0 110.224 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.42 -38.03 88.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.285 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -60.3 -43.15 96.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.313 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -65.0 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.227 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 66.27 112.13 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.817 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.1 mt -132.43 154.73 81.67 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.798 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -39.41 158.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.396 0 C-N-CA 122.768 2.312 . . . . 0.0 112.264 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -68.72 -46.57 1.7 Allowed 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 122.621 2.214 . . . . 0.0 112.3 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.96 -47.73 91.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.53 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -65.64 -39.2 91.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.349 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.85 -43.65 98.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.712 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -41.54 95.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.421 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -67.17 -45.19 77.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.98 -49.88 72.95 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.157 0.503 . . . . 0.0 110.641 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -60.96 -40.55 93.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.247 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.64 -40.66 92.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.374 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.07 -47.99 83.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.51 -40.31 96.34 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.543 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -58.29 -45.61 87.61 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.154 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -62.99 -42.61 97.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -51.89 -42.42 62.71 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -64.32 -44.52 91.3 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.783 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.426 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -61.61 -44.76 96.4 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.44 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -61.27 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.483 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -57.79 -49.14 77.63 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.815 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -61.27 -42.27 98.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.334 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.53 -46.46 88.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.558 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.418 ' CH2' ' HD2' ' A' ' 63' ' ' LYS . 60.8 t90 -57.75 -40.6 80.09 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -58.74 -46.3 87.71 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.939 179.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -60.67 -44.63 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.424 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.409 HD23 ' NZ ' ' A' ' 73' ' ' LYS . 8.1 mp -61.51 -41.47 97.36 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.001 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 87.7 tttt -60.17 -39.27 85.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.683 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.8 tt . . . . . 0 C--N 1.329 -0.294 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.73 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -57.32 -38.3 73.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.798 0.332 . . . . 0.0 110.278 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.409 ' NZ ' HD23 ' A' ' 62' ' ' LEU . 99.3 mttt -61.35 -45.58 93.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.138 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 tp10 -60.28 -40.28 89.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.004 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.56 91.55 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -62.78 -36.58 83.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.712 HD23 ' C ' ' A' ' 77' ' ' LEU . 7.8 tt -61.78 -47.36 85.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.351 179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -44.85 96.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.269 0.557 . . . . 0.0 109.75 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.56 ' O ' HG23 ' A' ' 83' ' ' VAL . 61.7 ttp180 -57.4 -42.92 83.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.946 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.442 ' O ' HG13 ' A' ' 84' ' ' ILE . 50.4 t30 -62.56 -39.64 94.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.597 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.598 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -58.03 -49.5 76.67 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.765 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -64.0 -39.41 94.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.223 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.1 t -61.49 -45.37 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.454 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.6 mt -59.2 -50.72 78.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.246 -179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.13 -40.9 95.08 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.839 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.63 94.38 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.904 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 47.7 tttp -63.88 -47.94 78.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.629 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.2 -23.3 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.951 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 70.22 27.47 72.8 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt . . . . . 0 C--N 1.331 -0.199 0 CA-C-O 120.873 0.368 . . . . 0.0 110.458 179.779 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.463 0.218 0 CA-C-O 120.8 0.333 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.416 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 54.2 mt-10 -64.05 -33.94 76.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.978 0.418 . . . . 0.0 110.648 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.591 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 67.9 mmtt -59.79 -46.91 87.74 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.448 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.534 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 31.0 mt -69.09 -47.45 65.2 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.565 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.7 t-105 -59.71 -48.7 80.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.247 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.416 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 2.1 m80 -69.68 -31.16 69.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.207 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.591 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.9 tptt -57.19 -51.19 70.33 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.806 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.38 -47.23 51.04 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 119.453 -0.899 . . . . 0.0 110.744 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.402 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 48.7 tttm -53.33 -51.03 63.72 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.816 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -74.54 -42.68 58.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.358 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -44.41 -27.81 0.48 Allowed 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.28 -96.46 0.11 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 119.609 -1.281 . . . . 0.0 111.506 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.705 ' O ' ' N ' ' A' ' 131' ' ' SER . 57.4 mttp -155.14 24.73 0.42 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.479 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.4 m-30 -59.48 50.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.451 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.705 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.8 m -107.52 113.26 26.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.199 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 120.98 -97.04 0.62 Allowed Glycine 0 CA--C 1.526 0.774 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.828 178.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.491 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 5.6 mp0 -74.41 -43.99 53.87 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.441 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.602 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 51.8 mp0 -63.0 -51.88 65.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.565 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -62.32 -40.26 95.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.935 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -61.66 -41.21 97.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.7 mttt -62.36 -44.05 97.39 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.05 0.452 . . . . 0.0 110.322 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mt -59.53 -43.73 93.38 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.57 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.2 OUTLIER -67.88 -33.82 75.48 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.562 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 71.7 mtp85 -53.93 -45.48 71.25 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 118.866 -1.134 . . . . 0.0 108.131 178.621 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.51 -37.19 71.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.604 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.57 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.6 m-85 -58.64 -58.16 9.78 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.821 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.97 -41.47 98.05 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.413 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.562 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 48.1 m170 -56.02 -42.62 76.76 Favored 'General case' 0 N--CA 1.46 0.065 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.678 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.831 ' O ' HG22 ' A' ' 149' ' ' VAL . 5.2 m80 -65.82 -39.99 91.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.787 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -59.43 -45.29 91.97 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.257 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -71.54 -46.86 58.38 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.625 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 68.2 mttm -62.69 -46.04 89.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.751 0.31 . . . . 0.0 111.282 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.831 HG22 ' O ' ' A' ' 145' ' ' HIS . 17.7 m -65.77 -37.85 80.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.597 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.739 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -65.28 -41.58 94.03 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.74 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.82 -45.26 93.44 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.558 ' CE1' ' NZ ' ' A' ' 193' ' ' LYS . 23.1 m-85 -69.54 -47.31 64.12 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -65.62 -40.79 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.643 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 150' ' ' HIS . 56.6 t -64.05 -43.7 97.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.711 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.448 179.619 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 . . . . . 0 CA--C 1.519 -0.25 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.552 HD23 ' HE3' ' A' ' 193' ' ' LYS . 10.5 mt -60.96 -41.47 96.39 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.546 -0.462 . . . . 0.0 109.998 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.52 ' HA ' HD23 ' A' ' 194' ' ' LEU . 68.5 mttm -68.19 -35.02 77.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.16 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 86.0 tt0 -67.8 -44.93 76.18 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.153 0.501 . . . . 0.0 111.622 -178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.558 ' NZ ' ' CE1' ' A' ' 152' ' ' TYR . 0.0 OUTLIER -71.87 -38.75 69.99 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.064 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.779 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -65.15 -41.9 94.3 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.969 -0.693 . . . . 0.0 110.351 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 192' ' ' GLU . 18.8 ptp180 -65.27 -38.14 89.36 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 196' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 79.1 p -60.87 -39.03 87.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 194' ' ' LEU . 97.1 mt -63.72 -42.78 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.605 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -58.49 -41.52 85.52 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -60.37 -38.6 84.4 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 200' ' ' GLY . . . . . 0.416 ' O ' ' HB3' ' A' ' 203' ' ' ARG . . . -60.1 -40.3 96.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' A' ' 201' ' ' LEU . 19.8 mt -62.16 -40.59 96.51 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.012 -0.675 . . . . 0.0 109.742 178.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -60.31 -37.42 80.51 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 200' ' ' GLY . 5.2 tmm_? -60.84 -41.38 95.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.461 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.18 -38.17 82.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -61.08 -42.54 98.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.284 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 210' ' ' GLN . 5.7 mmp_? -64.48 -36.14 83.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.327 179.158 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.698 ' O ' ' N ' ' A' ' 211' ' ' GLY . 25.2 t -63.02 -44.95 99.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.194 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.59 -26.79 62.75 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.559 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 209' ' ' HIS . . . . . 0.426 ' ND1' ' NH1' ' A' ' 206' ' ' ARG . 45.1 t-80 -94.23 -12.93 27.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.372 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.3 tt0 -136.86 -38.33 0.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.093 0.473 . . . . 0.0 110.442 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.698 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.589 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.534 ' HG2' ' H ' ' A' ' 220' ' ' GLU . 37.8 tt0 . . . . . 0 N--CA 1.442 -0.849 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.534 ' H ' ' HG2' ' A' ' 219' ' ' GLU . 16.9 tp10 63.43 125.41 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -48.02 121.21 5.66 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 121.38 1.387 . . . . 0.0 112.811 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 178.69 -102.52 0.0 OUTLIER 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.146 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.489 HG21 HD22 ' A' ' 308' ' ' LEU . 2.6 p -60.62 -48.93 86.51 Favored 'Isoleucine or valine' 0 C--O 1.249 1.035 0 CA-C-O 121.704 0.764 . . . . 0.0 110.763 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.43 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.8 OUTLIER -63.81 -31.47 53.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.438 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 225' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 51.9 t0 -64.36 -37.99 89.46 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.4 tp -59.44 -42.84 92.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.625 ' CH2' HD23 ' A' ' 308' ' ' LEU . 45.9 m0 -60.36 -36.45 78.06 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.045 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 228' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 225' ' ' ASP . 94.0 m-20 -59.43 -40.93 88.33 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.475 ' C ' ' H ' ' A' ' 231' ' ' GLN . 8.8 mp -63.91 -40.67 97.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.321 0.582 . . . . 0.0 109.512 179.123 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.626 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -53.04 -8.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.846 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.853 ' O ' HD21 ' A' ' 240' ' ' LEU . 11.4 tp-100 -62.86 -43.73 98.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.795 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 54.0 p -145.0 16.48 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.576 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -59.67 -49.86 76.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.697 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.8 p30 177.54 77.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.595 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.626 HD12 ' O ' ' A' ' 230' ' ' ALA . 96.1 mt -137.19 161.89 34.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.674 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.0 p -72.95 -162.44 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.617 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -92.19 -55.58 3.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -61.93 -41.34 97.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.985 0.421 . . . . 0.0 110.335 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -63.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.853 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.2 OUTLIER -62.81 -43.02 99.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.162 -179.699 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -64.27 -49.44 71.87 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.856 0.36 . . . . 0.0 110.775 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.44 -39.77 94.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.978 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.5 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -68.01 -42.6 80.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.345 179.089 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 244' ' ' ARG . . . . . 0.542 ' NH2' ' OE1' ' A' ' 231' ' ' GLN . 59.2 ttm-85 -59.17 -50.17 75.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.976 -178.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.3 -40.61 86.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.791 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -62.07 -46.93 86.95 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.162 0.506 . . . . 0.0 110.415 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 251' ' ' GLU . 1.0 OUTLIER -62.02 -41.68 98.35 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.171 179.49 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.04 -42.88 81.3 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.119 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.42 -55.79 30.22 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.664 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -63.66 -33.85 76.54 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.694 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 29.3 tp10 -59.72 -43.33 94.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.053 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.44 86.65 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.398 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -59.9 -48.17 82.8 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.705 -179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 251' ' ' GLU . 1.3 tt -66.47 -31.76 55.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.272 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.32 -48.87 79.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.186 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.14 -42.25 99.44 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.372 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -57.64 -42.77 84.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.127 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.56 -40.43 96.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.356 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 259' ' ' HIS . . . . . 0.403 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 8.0 t60 -58.38 -48.06 81.83 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.239 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -62.81 -37.08 85.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.482 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -59.17 -45.5 90.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.789 0.328 . . . . 0.0 110.435 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -61.73 -45.43 93.99 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 263' ' ' GLN . . . . . 0.403 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.8 mp0 -64.94 -34.92 79.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.988 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.16 -43.12 99.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.335 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -65.31 -48.22 73.84 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.992 0.425 . . . . 0.0 110.66 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 66.5 mt -63.14 -43.33 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.128 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.07 -36.94 83.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.23 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -63.03 -46.59 86.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.378 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.98 -44.55 95.74 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.453 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.41 -42.87 99.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.465 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.712 HD23 ' O ' ' A' ' 271' ' ' LEU . 2.7 tt -60.72 -43.9 97.28 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.752 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -58.66 -44.75 90.25 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.165 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 -67.75 -36.01 79.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.626 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.408 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.96 -37.11 85.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.009 -179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -58.84 -17.06 20.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.396 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 60.4 p -89.3 2.62 54.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.68 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.544 HG13 ' N ' ' A' ' 278' ' ' GLY . 14.8 p -60.18 -43.48 93.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.677 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.544 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 119.67 -67.86 0.39 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -88.61 116.91 27.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.781 0.324 . . . . 0.0 110.349 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -64.95 116.05 8.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -145.34 -44.62 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.7 0.286 . . . . 0.0 110.408 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -105.76 -6.18 19.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.457 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.55 -45.8 96.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.528 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 284' ' ' SER . . . . . 0.418 ' O ' ' HG2' ' A' ' 288' ' ' GLU . 44.5 t -63.49 -51.63 64.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.513 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.82 -44.44 96.83 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.981 0.419 . . . . 0.0 110.853 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 38.6 m -60.32 -42.99 96.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.382 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -63.54 -38.33 90.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.933 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 288' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 284' ' ' SER . 76.0 mm-40 -59.89 -61.45 2.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.531 ' HD3' HD23 ' A' ' 292' ' ' LEU . 29.4 mmtt -63.4 -39.71 95.24 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.018 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -45.16 -55.41 5.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.938 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -65.43 -35.69 81.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.679 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.531 HD23 ' HD3' ' A' ' 289' ' ' LYS . 16.5 tp -60.63 -49.04 79.14 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.497 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.67 -41.52 98.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 109.973 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 295' ' ' GLY . 0.1 OUTLIER -63.92 -39.94 95.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 295' ' ' GLY . . . . . 0.401 ' N ' ' HG2' ' A' ' 294' ' ' GLU . . . -59.99 -50.78 63.99 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 -179.587 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 296' ' ' ARG . . . . . 0.433 ' CZ ' ' OE1' ' A' ' 299' ' ' GLU . 10.6 tpp180 -60.4 -37.79 81.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.909 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.1 m -58.91 -48.15 82.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.327 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -63.59 -41.53 98.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.729 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 299' ' ' GLU . . . . . 0.433 ' OE1' ' CZ ' ' A' ' 296' ' ' ARG . 96.6 mt-10 -58.77 -43.82 90.49 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.138 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.5 -43.99 97.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.393 -0.523 . . . . 0.0 109.906 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.75 -41.9 84.07 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -61.16 -45.88 92.83 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.145 0.498 . . . . 0.0 110.455 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.5 m -60.14 -43.37 95.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.313 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.36 -43.12 93.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.052 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -58.66 -46.12 87.85 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.805 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.99 -42.86 99.96 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.559 179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -65.42 -35.42 80.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.137 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.625 HD23 ' CH2' ' A' ' 227' ' ' TRP . 21.7 mt -62.29 -43.58 98.5 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.362 179.528 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 19.5 tm0? -65.49 -46.52 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -64.31 -49.02 73.43 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.079 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 33.1 mt -62.86 -42.78 99.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 51.0 m -60.95 -41.87 97.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.299 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.48 98.22 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.3 -47.99 79.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.773 0.32 . . . . 0.0 110.74 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 315' ' ' ILE . . . . . 0.481 ' O ' ' C ' ' A' ' 316' ' ' SER . 17.0 mt -77.71 -25.4 14.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 316' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 315' ' ' ILE . 42.6 t -33.1 -54.59 0.39 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.742 -179.234 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.2 ptt85 . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.484 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 120.698 0.285 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -81.1 -15.43 55.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.936 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.04 145.85 51.15 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 121.401 0.62 . . . . 0.0 111.166 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -64.99 -36.51 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.363 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.1 tttp -57.57 -47.93 80.76 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.276 0.56 . . . . 0.0 110.466 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.3 mt -60.8 -39.47 89.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.344 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -63.47 -39.84 95.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -57.41 -48.91 77.86 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.373 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 28' ' ' LEU . 4.2 mm? -61.38 -42.82 99.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.23 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.501 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 46.5 t-105 -61.48 -42.35 98.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.266 0.555 . . . . 0.0 110.417 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -57.72 -44.6 86.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.403 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.8 -41.57 95.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.356 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.27 93.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.428 . . . . 0.0 110.427 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.501 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.5 mt-30 -62.46 -39.42 93.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.329 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.24 -40.92 97.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.361 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.02 -39.86 95.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.429 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.64 106.94 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.896 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -129.45 155.06 80.73 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -40.47 154.33 0.06 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.65 2.233 . . . . 0.0 112.245 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.93 -36.07 32.35 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.594 2.196 . . . . 0.0 112.296 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.73 -49.77 75.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.017 0.437 . . . . 0.0 110.747 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -68.25 -39.29 82.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.464 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -63.03 -43.41 98.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.88 -43.67 87.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.634 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.57 -44.26 74.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.765 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.63 -48.4 79.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.565 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -60.88 -41.63 96.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.35 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.622 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.69 -48.79 79.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.734 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -56.37 -47.92 77.9 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.536 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.64 -39.25 83.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.075 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.98 -38.07 84.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.95 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 47' ' ' ALA . 38.6 mm -62.92 -44.38 99.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.899 179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -58.31 -43.64 88.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.332 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -60.52 -47.48 85.98 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.171 0.51 . . . . 0.0 110.322 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -62.59 -41.33 98.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.693 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -63.87 -37.33 86.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.301 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -62.63 -46.99 85.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.103 0.477 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.1 tp -61.4 -41.32 96.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.995 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.04 -41.99 99.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.532 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -58.96 -43.35 91.3 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.924 0.393 . . . . 0.0 110.275 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.78 -45.87 92.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -57.75 -42.42 83.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.997 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.4 mt -62.53 -42.34 99.46 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.016 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -56.48 -43.65 79.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.879 179.017 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.736 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -60.48 -39.18 86.71 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.345 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.518 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 3.4 mptp? -54.79 -55.87 25.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.914 0.388 . . . . 0.0 110.52 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -57.84 -39.89 78.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.021 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.53 -41.38 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.54 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.518 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 89.7 mtm180 -65.16 -39.98 93.7 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.69 -44.91 92.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.392 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.53 -45.14 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.238 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.493 ' O ' HG23 ' A' ' 83' ' ' VAL . 73.4 ttt180 -60.63 -43.24 97.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.128 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.455 ' OD1' HD11 ' A' ' 84' ' ' ILE . 26.0 t-20 -64.06 -40.13 95.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.58 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.688 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.45 -46.68 88.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.045 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -64.92 -39.87 94.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.588 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.8 t -63.75 -46.5 94.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.432 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.455 HD11 ' OD1' ' A' ' 80' ' ' ASN . 96.6 mt -60.13 -49.88 82.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.558 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' A' ' 85' ' ' LEU . 19.3 mt -65.09 -40.69 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.062 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.01 -41.1 97.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.795 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -64.77 -46.78 80.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.775 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -76.05 -19.59 58.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.394 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 65.29 26.53 71.7 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.9 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 110.669 179.971 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.954 0.407 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -60.51 -39.24 87.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.521 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.572 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.4 mttt -61.0 -44.2 97.77 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.494 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.75 -46.54 84.85 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.943 0.402 . . . . 0.0 111.71 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.587 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.7 t-105 -60.0 -47.54 85.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.369 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -71.17 -32.97 69.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.429 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.572 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.8 OUTLIER -56.59 -51.02 70.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.86 -178.978 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.63 -46.74 58.22 Favored 'General case' 0 C--O 1.247 0.936 0 C-N-CA 120.017 -0.673 . . . . 0.0 110.596 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -52.97 -45.21 67.69 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.914 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.7 m -85.41 -40.94 15.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.691 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.557 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 13.7 m -44.54 -29.88 0.79 Allowed 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -155.36 -96.59 0.13 Allowed Glycine 0 N--CA 1.463 0.472 0 C-N-CA 119.751 -1.214 . . . . 0.0 111.31 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.731 ' O ' ' N ' ' A' ' 131' ' ' SER . 65.1 mttp -154.51 17.58 0.47 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -57.93 51.04 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.811 -179.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.731 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.5 m -109.13 123.54 49.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.139 0.495 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.61 -97.8 1.2 Allowed Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.142 178.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -74.96 -39.87 61.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.993 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.401 ' O ' HD23 ' A' ' 138' ' ' LEU . 58.5 mp0 -63.45 -52.71 60.28 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.067 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.587 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -59.8 -39.96 86.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.352 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -61.82 -38.66 88.99 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -63.1 -42.89 99.66 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.444 0.64 . . . . 0.0 109.854 178.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 138' ' ' LEU . 4.2 mm? -59.45 -42.55 92.23 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.21 -37.57 87.94 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -53.54 -41.16 66.15 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 178.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.931 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 79.9 mm-40 -69.66 -47.32 63.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -57.42 -48.75 78.29 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.2 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 143' ' ' LEU . 95.2 mt -59.76 -41.33 90.78 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.071 -0.651 . . . . 0.0 110.205 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.931 ' ND1' ' O ' ' A' ' 141' ' ' GLU . 1.8 p-80 -55.84 -43.03 76.65 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.024 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.706 ' N ' ' CD2' ' A' ' 144' ' ' HIS . 2.7 m80 -59.8 -41.98 92.42 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.449 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -62.65 -42.44 99.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.313 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.555 ' HA ' ' CE1' ' A' ' 150' ' ' HIS . 96.5 mt-10 -67.59 -44.09 78.95 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.206 0.527 . . . . 0.0 111.297 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.47 -42.24 71.71 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.146 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.99 -50.56 76.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.828 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.1 OUTLIER -72.75 -18.89 61.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.25 -179.642 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.638 ' HG2' ' CE1' ' A' ' 150' ' ' HIS . 9.7 mm-40 -70.89 -48.69 52.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.528 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 29.2 m-85 -63.77 -41.22 98.02 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.767 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.85 -38.46 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.938 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.828 HG23 ' O ' ' A' ' 150' ' ' HIS . 19.3 t -61.25 -46.28 96.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.265 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 C--N 1.324 -0.542 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.814 -179.709 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.455 ' O ' ' CD ' ' A' ' 193' ' ' LYS . 97.5 mt-10 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.833 0.349 . . . . 0.0 110.077 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.468 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 3.5 mt -61.23 -42.05 97.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.351 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.84 -29.36 67.67 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 76.3 tt0 -69.94 -50.97 36.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.978 0.418 . . . . 0.0 111.629 -179.122 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.528 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 1.1 ptmt -71.94 -39.41 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.783 -0.367 . . . . 0.0 111.247 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.795 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.45 -41.45 72.82 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.93 -179.493 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.518 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 50.2 ptt85 -65.87 -37.46 86.2 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 96.0 p -62.73 -41.45 99.19 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.577 HG23 ' CD2' ' A' ' 145' ' ' HIS . 91.9 mt -65.72 -43.69 93.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.824 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -63.51 -41.27 98.51 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.685 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.855 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 47.1 mm-40 -63.5 -33.02 74.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.207 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.57 -40.6 90.73 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 201' ' ' LEU . 37.3 mt -63.74 -43.34 96.76 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.205 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.904 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 9.1 p-10 -65.82 -34.23 77.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.595 0.712 . . . . 0.0 109.213 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.904 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.1 tmt_? -63.43 -42.6 98.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.375 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 204' ' ' LEU . 49.4 mt -61.18 -39.78 91.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 33.6 mmt180 -60.19 -43.1 96.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.045 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.611 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.8 mtm-85 -64.76 -36.79 85.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.391 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.67 ' O ' ' N ' ' A' ' 211' ' ' GLY . 47.2 t -63.17 -46.46 95.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.041 0.448 . . . . 0.0 110.176 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.7 p -74.24 -26.64 60.35 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.928 0.394 . . . . 0.0 110.764 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -95.05 -14.37 24.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.292 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.611 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -138.11 -30.19 0.81 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.043 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.67 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.484 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 . . . . . 0 N--CA 1.447 -0.623 0 CA-C-O 120.856 0.36 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.86 ' O ' HG12 ' A' ' 223' ' ' VAL . 39.5 tp10 -174.01 126.77 0.44 Allowed Pre-proline 0 C--O 1.225 -0.19 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.811 176.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.631 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 72.6 Cg_exo -43.42 159.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.377 2.051 . . . . 0.0 111.755 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.631 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 65.8 ttp85 95.74 -54.44 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.619 0.575 . . . . 0.0 110.705 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 1.007 HG13 ' H ' ' A' ' 224' ' ' ILE . 4.9 p -55.91 -83.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.598 0 CA-C-O 121.351 0.596 . . . . 0.0 110.878 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 1.007 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -57.1 -24.58 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.036 -179.797 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -64.36 -47.55 78.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.096 0.474 . . . . 0.0 109.731 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.433 HD23 HD12 ' A' ' 229' ' ' LEU . 24.1 mt -61.35 -42.82 99.31 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.77 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.493 ' HB3' HD11 ' A' ' 247' ' ' LEU . 43.6 m0 -60.88 -36.17 78.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.983 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 228' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 228' ' ' ASP . 64.8 t0 -63.74 -38.3 90.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.663 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 231' ' ' GLN . 95.0 mt -62.62 -42.18 99.43 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.1 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.403 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -38.12 -25.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.095 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 229' ' ' LEU . 55.7 tt0 -69.65 -72.47 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.805 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 79.1 p -66.18 -18.49 65.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -57.4 -53.88 53.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.876 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 234' ' ' ASN . . . . . 0.64 ' CG ' ' H ' ' A' ' 235' ' ' LEU . 48.5 t-20 -178.79 -143.11 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.046 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.64 ' H ' ' CG ' ' A' ' 234' ' ' ASN . 36.7 mt 80.32 144.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.661 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 24.1 p -80.57 172.47 13.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 237' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 33.0 p-10 -55.86 -44.12 77.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.638 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 238' ' ' LYS . . . . . 0.467 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.6 -47.99 81.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.011 0.434 . . . . 0.0 110.662 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -65.85 -36.11 82.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.68 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.755 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.46 -43.12 98.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.196 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -62.9 -48.97 76.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.477 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.17 -48.69 80.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.504 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -63.64 -39.72 95.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.323 179.283 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -57.44 -50.32 73.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.961 0.41 . . . . 0.0 110.528 -179.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.61 -36.26 83.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.563 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -60.13 -51.87 67.77 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.51 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.51 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.12 -40.38 97.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.886 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 79.3 tttt -55.65 -45.4 77.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.196 0.522 . . . . 0.0 110.337 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.86 -37.03 81.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.288 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -61.23 -49.33 77.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.065 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 11.9 pt-20 -62.83 -37.08 85.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.058 0.456 . . . . 0.0 109.851 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.83 87.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.617 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -63.53 -48.97 75.36 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.245 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.5 tt -64.2 -34.17 67.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.26 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -63.05 -48.34 79.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.053 0.454 . . . . 0.0 110.399 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.217 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 257' ' ' HIS . . . . . 0.479 ' CE1' HE21 ' A' ' 261' ' ' GLN . 7.2 t-80 -55.75 -43.2 76.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.029 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -61.83 -40.47 95.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.088 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -59.16 -47.83 83.85 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.249 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -64.24 -32.91 74.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.378 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 261' ' ' GLN . . . . . 0.479 HE21 ' CE1' ' A' ' 257' ' ' HIS . 20.1 mm-40 -61.08 -48.69 80.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.861 0.363 . . . . 0.0 110.186 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -61.93 -43.54 98.64 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 38.3 tp60 -64.27 -36.85 85.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.002 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 41.6 tp -62.4 -42.47 99.45 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.137 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -62.41 -46.05 90.34 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.381 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 88.0 mt -62.51 -43.48 98.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.3 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.2 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.39 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -61.28 -46.96 88.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.211 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -61.93 -46.15 90.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.37 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -62.0 -39.2 91.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.52 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.661 HD23 ' O ' ' A' ' 271' ' ' LEU . 1.3 tt -60.11 -44.16 95.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.887 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -63.08 -40.19 96.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.271 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -67.33 -41.61 84.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.759 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.747 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.6 -41.92 99.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.82 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -56.95 -17.56 10.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.94 0.4 . . . . 0.0 110.539 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.6 t -62.6 -34.09 76.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.542 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.838 HG13 ' H ' ' A' ' 279' ' ' ASP . 8.4 p -59.16 -40.03 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.323 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 64.94 26.93 71.6 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 279' ' ' ASP . . . . . 0.838 ' H ' HG13 ' A' ' 277' ' ' VAL . 25.6 t0 -108.19 -8.8 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.318 . . . . 0.0 110.556 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 280' ' ' GLY . . . . . 0.62 ' C ' ' H ' ' A' ' 282' ' ' ARG . . . 63.99 -141.64 45.28 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 281' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 281' ' ' GLU . 78.2 tt0 58.56 -5.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 282' ' ' ARG . . . . . 0.62 ' H ' ' C ' ' A' ' 280' ' ' GLY . 41.9 ttm180 -140.02 -31.07 0.66 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.516 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.83 -44.07 98.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.418 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 39.6 t -60.78 -53.15 60.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.08 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 74.0 mtp85 -60.82 -46.63 89.79 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.913 0.387 . . . . 0.0 111.064 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 19.6 m -59.1 -40.24 84.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -65.78 -39.38 90.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.547 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -58.7 -59.65 5.07 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.28 0.562 . . . . 0.0 110.429 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.607 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.5 mmtm -63.23 -35.84 81.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.309 179.517 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -52.16 -49.04 64.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.045 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.66 -31.93 70.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.258 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.607 HD23 ' HD3' ' A' ' 289' ' ' LYS . 16.8 tp -64.25 -53.29 51.46 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.51 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.0 mp -63.6 -41.53 98.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.012 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -64.77 -39.57 93.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.169 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.15 -45.43 96.57 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 296' ' ' ARG . . . . . 0.653 ' HE ' ' C ' ' A' ' 296' ' ' ARG . 1.4 tmm_? -63.63 -41.88 98.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.058 0.456 . . . . 0.0 110.14 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.1 m -58.45 -49.59 76.78 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.47 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -40.13 96.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.417 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -58.48 -42.67 88.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -44.31 96.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.919 0.39 . . . . 0.0 110.462 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.28 -45.42 92.77 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -62.11 -41.76 98.55 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.098 0.475 . . . . 0.0 110.463 179.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 14.5 m -61.1 -43.97 98.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.502 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -60.03 -43.21 92.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.96 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -59.16 -48.97 79.63 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.196 0.522 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -61.74 -44.8 96.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.226 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.581 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.8 OUTLIER -63.36 -36.05 82.42 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.915 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.471 ' O ' ' OG ' ' A' ' 312' ' ' SER . 0.4 OUTLIER -58.0 -45.42 86.85 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.413 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -71.66 -57.63 4.21 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.272 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.34 -49.58 76.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.55 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 4.4 tp -61.55 -43.03 99.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.506 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 312' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 51.8 p -60.0 -40.54 89.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.15 -38.27 95.06 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.24 -45.0 95.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.78 0.324 . . . . 0.0 110.659 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 315' ' ' ILE . . . . . 0.638 ' O ' ' N ' ' A' ' 317' ' ' ARG . 4.1 mm -61.0 -100.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.454 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 316' ' ' SER . . . . . 0.53 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.4 m 30.54 -87.11 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.309 0.576 . . . . 0.0 110.264 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.638 ' N ' ' O ' ' A' ' 315' ' ' ILE . 11.4 ptp85 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.46 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.481 0.182 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -67.25 -18.77 65.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.88 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.4 mmt -129.6 148.05 51.46 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.295 0.569 . . . . 0.0 111.116 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.669 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 49.7 mp0 -66.42 -40.94 89.86 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.698 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -56.01 -47.79 77.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.121 0.486 . . . . 0.0 110.469 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 25' ' ' LEU . 94.8 mt -61.59 -39.41 91.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.295 0.569 . . . . 0.0 109.506 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.24 -40.25 95.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.185 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.48 -42.71 96.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.209 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.88 -43.8 98.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.944 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.577 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 56.7 t-105 -61.8 -44.01 97.71 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.293 0.568 . . . . 0.0 110.369 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -56.66 -42.6 79.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.103 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.24 -42.93 99.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.205 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.73 -41.25 90.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.99 0.424 . . . . 0.0 110.274 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.577 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 73.8 mt-30 -58.79 -47.29 85.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.184 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -63.56 -34.77 78.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.19 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 35' ' ' LEU . 14.4 tp -62.43 -36.64 83.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.284 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 35' ' ' LEU . 21.3 m-70 65.89 110.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.074 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -134.74 154.19 79.3 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.74 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -40.61 153.92 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 122.562 2.174 . . . . 0.0 112.423 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.86 -50.2 5.59 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.682 2.255 . . . . 0.0 112.457 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.27 -47.82 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.575 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.4 ' NH2' ' CZ ' ' A' ' 88' ' ' TYR . 64.8 ttt-85 -63.24 -39.47 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.083 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.89 -44.42 96.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.716 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.63 94.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.401 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.58 -44.99 69.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.449 HD13 ' OH ' ' A' ' 88' ' ' TYR . 44.3 tp -63.46 -46.87 84.24 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -62.09 -42.27 99.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.37 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.29 90.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.457 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -59.71 -52.56 64.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.495 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.51 -39.73 94.45 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.2 0.524 . . . . 0.0 110.378 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.3 -45.53 87.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.016 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.61 -42.68 96.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.822 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -52.28 -42.93 64.13 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -64.86 -41.31 95.79 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -61.63 -46.71 88.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.241 0.543 . . . . 0.0 110.586 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -63.28 -35.7 81.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.485 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.41 ' OE1' ' C ' ' A' ' 56' ' ' GLU . 10.4 tm-20 -58.14 -47.66 82.65 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.985 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 57' ' ' LEU . 30.7 mt -62.31 -42.38 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.305 179.291 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.03 -44.36 96.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.477 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.5 t90 -59.14 -41.63 88.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -60.16 -45.89 91.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -58.39 -43.28 88.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.977 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -61.91 -39.41 91.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.851 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.35 -41.96 90.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.056 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.529 0.928 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -68.15 -34.25 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.859 0.362 . . . . 0.0 110.622 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.5 mttt -59.03 -59.05 6.09 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.71 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 13.5 pt-20 -58.76 -39.23 80.39 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.043 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.403 ' N ' ' HG3' ' A' ' 74' ' ' GLU . . . -58.75 -41.43 86.48 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.406 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -64.95 -41.2 95.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.9 0.381 . . . . 0.0 110.07 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.27 -43.9 93.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.253 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 94.2 mt -64.24 -47.49 89.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.07 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.675 ' O ' HG23 ' A' ' 83' ' ' VAL . 10.3 tpp180 -60.42 -44.21 95.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.194 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.436 ' O ' HG13 ' A' ' 84' ' ' ILE . 44.9 t30 -61.91 -41.04 97.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.511 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.61 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.01 -50.13 74.48 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.129 -179.427 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -64.93 -37.17 86.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.32 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 79' ' ' ARG . 59.0 t -63.78 -45.96 95.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.442 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.01 -51.23 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.464 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.63 -40.36 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.788 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.56 79.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.966 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -61.4 -47.94 83.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.55 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.449 ' OH ' HD13 ' A' ' 45' ' ' LEU . 5.7 m-85 -61.95 -30.29 70.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.069 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.02 18.94 80.16 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 51.2 mt . . . . . 0 C--N 1.331 -0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.323 179.915 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.936 0.398 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -61.67 -38.13 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.579 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.602 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 63.7 mttp -61.22 -45.74 93.31 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.54 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.529 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 41.5 mt -64.13 -46.15 85.43 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.913 0.387 . . . . 0.0 111.888 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.648 ' CE2' HD13 ' A' ' 135' ' ' LEU . 18.0 t-105 -57.8 -49.38 76.82 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.755 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -72.76 -31.99 65.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.46 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 1.0 OUTLIER -54.82 -51.52 65.59 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.73 -179.109 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.71 -46.59 52.9 Favored 'General case' 0 C--O 1.247 0.924 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.69 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 49.7 tttm -50.34 -41.59 51.6 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.781 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.5 m -95.08 -38.14 10.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.95 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -45.45 -27.34 0.7 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.961 0.41 . . . . 0.0 109.952 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.79 -92.26 0.09 OUTLIER Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.339 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -162.79 25.1 0.1 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.361 0.6 . . . . 0.0 109.525 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.423 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 8.7 m-85 -69.76 51.06 0.11 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.378 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 2.0 m -106.48 139.11 41.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.25 0.548 . . . . 0.0 111.747 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 89.12 -98.11 2.4 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.589 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 81.6 mm-40 -72.96 -43.83 61.83 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.96 -179.311 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -61.27 -49.35 77.42 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.304 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.648 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.5 mt -59.73 -40.4 87.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.306 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.56 -41.01 98.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.026 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.8 mttt -60.56 -42.75 97.24 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 121.387 0.613 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.71 -42.96 94.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.29 94.26 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.834 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -51.69 -41.64 61.6 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.65 -40.89 76.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.508 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.529 ' HZ ' HD13 ' A' ' 120' ' ' LEU . 10.7 m-85 -60.38 -52.43 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.429 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.36 -41.09 92.98 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.247 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -53.88 -46.69 71.41 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.51 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.833 ' O ' HG22 ' A' ' 149' ' ' VAL . 9.3 m-70 -61.37 -40.58 94.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.106 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -59.37 -43.67 92.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.343 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 143' ' ' LEU . 3.7 mp0 -70.7 -46.88 62.3 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.553 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.5 mttp -62.15 -47.05 86.26 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.12 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.833 HG22 ' O ' ' A' ' 145' ' ' HIS . 26.1 m -65.59 -37.13 79.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.02 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.724 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -63.81 -41.19 97.94 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.416 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -65.47 -45.65 82.87 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.332 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -62.86 -47.25 84.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 110.616 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -70.54 -46.61 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.226 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 150' ' ' HIS . 75.6 t -62.27 -46.06 97.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.702 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.4 mt . . . . . 0 C--N 1.324 -0.536 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.447 -179.443 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 . . . . . 0 CA--C 1.521 -0.151 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.592 ' HA ' ' HZ2' ' A' ' 193' ' ' LYS . 9.7 mp -63.26 -44.21 95.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 62.5 mttp -67.87 -40.0 83.64 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -68.66 -50.56 50.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.839 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.592 ' HZ2' ' HA ' ' A' ' 190' ' ' LEU . 2.6 pttm -67.09 -42.93 83.79 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.202 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.751 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.74 -37.84 76.62 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.47 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.508 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 11.6 mmm180 -63.4 -39.87 95.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 58.1 m -62.02 -42.59 99.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.77 -44.09 96.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.786 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -62.78 -40.98 99.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.522 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.58 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 95.2 mt-30 -62.03 -37.91 86.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.293 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.82 -41.48 98.82 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 201' ' ' LEU . 26.7 mt -63.82 -40.56 96.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.009 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -61.91 -38.17 87.39 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.413 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -63.45 -42.63 98.64 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.678 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.2 mt -60.56 -40.15 90.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.354 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -64.19 -43.08 96.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.062 179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.732 ' O ' ' N ' ' A' ' 210' ' ' GLN . 95.8 mtt-85 -63.14 -44.67 94.9 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.228 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.7 OUTLIER -64.39 -38.17 81.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.754 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 18.6 m -62.15 -35.7 79.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -103.89 -19.6 14.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.241 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.732 ' N ' ' O ' ' A' ' 206' ' ' ARG . 44.1 tt0 -115.84 -26.0 7.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.441 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.5 ' O ' ' HG2' ' A' ' 219' ' ' GLU . 81.1 tt0 . . . . . 0 CA--C 1.532 0.269 0 CA-C-O 120.847 0.356 . . . . 0.0 110.645 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.469 ' C ' ' O ' ' A' ' 219' ' ' GLU . 3.7 mp0 -34.86 151.04 0.07 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.663 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -76.2 47.83 2.13 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.488 2.125 . . . . 0.0 112.223 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.502 ' HE ' ' HA ' ' A' ' 222' ' ' ARG . 0.0 OUTLIER -125.86 -82.57 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.798 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.454 HG13 ' H ' ' A' ' 224' ' ' ILE . 0.3 OUTLIER -59.61 -53.37 49.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.495 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.7 OUTLIER -62.09 -34.96 66.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.356 0.598 . . . . 0.0 109.495 -179.467 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -65.91 -36.39 83.24 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.66 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.34 -43.06 92.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.61 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 43.4 m0 -62.42 -37.85 87.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.738 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -58.75 -40.61 84.37 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 231' ' ' GLN . 89.2 mt -62.96 -42.39 99.81 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.75 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.726 ' O ' HD11 ' A' ' 235' ' ' LEU . . . -38.96 -27.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 229' ' ' LEU . 17.4 tt0 -60.47 -42.44 96.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.634 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.8 m -125.64 61.66 1.23 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.655 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -127.73 -70.79 0.69 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.551 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -173.31 89.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.846 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.726 HD11 ' O ' ' A' ' 230' ' ' ALA . 0.1 OUTLIER -136.01 -156.13 0.69 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.68 -179.679 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 168.49 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.499 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -59.69 -54.55 45.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.858 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.43 -41.77 93.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.172 0.511 . . . . 0.0 110.558 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -59.43 -34.27 72.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.201 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 240' ' ' LEU . 0.1 OUTLIER -62.11 -43.25 99.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.793 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -65.85 -50.6 63.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.535 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.72 89.33 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.132 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.47 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -65.02 -42.13 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.329 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -54.69 -52.93 60.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.983 0.42 . . . . 0.0 110.434 -179.162 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -65.61 -38.84 90.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.92 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -57.41 -54.14 50.24 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.364 0.602 . . . . 0.0 110.616 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 247' ' ' LEU . 4.6 mm? -63.05 -37.13 85.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.534 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.558 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 43.3 tttp -55.32 -43.0 74.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 110.223 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -70.18 -39.3 75.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.334 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -60.65 -49.29 78.1 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.29 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.597 ' OE1' ' N ' ' A' ' 252' ' ' ALA . 0.1 OUTLIER -62.09 -39.4 92.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 252' ' ' ALA . . . . . 0.597 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.14 -37.32 85.41 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.536 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -62.74 -48.4 79.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.053 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -37.98 81.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.309 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -59.18 -47.13 86.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.511 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -63.21 -43.34 98.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.293 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 257' ' ' HIS . . . . . 0.404 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -58.2 -43.81 87.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.361 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 258' ' ' ASN . . . . . 0.421 ' OD1' ' C ' ' A' ' 258' ' ' ASN . 43.4 t-20 -61.14 -41.54 96.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.344 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 34.5 t-80 -60.58 -48.56 81.24 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.1 0.476 . . . . 0.0 110.529 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -62.7 -34.56 77.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.397 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -62.62 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.219 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.32 -47.72 83.0 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.087 0.47 . . . . 0.0 109.903 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.58 -37.19 86.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.936 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 61.7 tp -62.96 -42.36 99.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.198 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -61.82 -48.82 78.88 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.508 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.29 -42.77 96.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.012 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.91 83.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.153 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -62.85 -48.43 79.06 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.408 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -59.91 -46.12 90.36 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 110.473 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.36 -40.65 95.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.364 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.415 HD13 ' CB ' ' A' ' 286' ' ' SER . 33.8 tp -59.73 -43.35 94.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.086 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -59.82 -44.14 94.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.12 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -68.15 -40.7 82.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.727 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.578 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.11 -37.04 83.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.728 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 275' ' ' GLU . . . . . 0.666 ' OE2' HG13 ' A' ' 283' ' ' VAL . 62.1 mm-40 -55.11 -19.56 7.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.871 0.367 . . . . 0.0 110.619 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 71.1 m -76.58 -11.46 59.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.613 HG13 ' N ' ' A' ' 278' ' ' GLY . 7.9 p -63.06 -46.91 94.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.686 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.613 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 79.95 -13.3 25.86 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 279' ' ' ASP . . . . . 0.475 ' H ' HG13 ' A' ' 277' ' ' VAL . 81.3 m-20 -76.65 -11.6 59.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.782 0.325 . . . . 0.0 110.608 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 280' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 65.01 -140.35 41.83 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 60.72 -71.87 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.893 0.378 . . . . 0.0 110.598 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 282' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 280' ' ' GLY . 55.2 ttt85 -60.94 -33.51 73.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.416 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 283' ' ' VAL . . . . . 0.666 HG13 ' OE2' ' A' ' 275' ' ' GLU . 42.7 t -59.78 -45.65 94.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.548 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 45.6 t -61.16 -47.42 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.979 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.05 -47.3 80.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.922 0.391 . . . . 0.0 111.037 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 286' ' ' SER . . . . . 0.415 ' CB ' HD13 ' A' ' 271' ' ' LEU . 44.4 m -59.93 -43.31 95.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.685 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -63.91 -40.63 96.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -58.79 -59.11 5.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.322 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.66 ' HD3' HD23 ' A' ' 292' ' ' LEU . 21.3 mmtm -63.96 -40.93 97.54 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.956 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -44.65 -53.96 6.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.16 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.4 -35.43 79.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.438 179.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.66 HD23 ' HD3' ' A' ' 289' ' ' LYS . 20.8 tp -60.39 -50.22 74.47 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.322 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.36 -42.08 98.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.303 0.573 . . . . 0.0 109.936 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.501 ' O ' ' OG1' ' A' ' 297' ' ' THR . 16.2 tm-20 -62.0 -39.71 93.16 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.955 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.91 -40.91 99.86 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 7.9 tpp180 -61.73 -43.73 98.28 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.323 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.501 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 44.0 p -60.42 -43.85 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.263 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -62.78 -43.92 97.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.461 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -61.5 -42.02 98.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.283 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -44.59 96.46 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.412 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.26 -44.89 93.21 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -62.15 -41.98 98.81 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.115 0.483 . . . . 0.0 110.462 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 303' ' ' THR . . . . . 0.423 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 19.3 m -60.52 -44.5 95.97 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.424 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -61.26 -42.35 93.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.896 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -56.98 -48.33 78.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.075 0.465 . . . . 0.0 110.313 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.34 -41.55 98.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.694 179.312 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.423 ' ND1' ' O ' ' A' ' 303' ' ' THR . 37.4 m80 -65.01 -36.47 84.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.239 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.61 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 6.0 mt -62.38 -44.84 95.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.835 0.35 . . . . 0.0 110.34 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -69.86 -42.87 72.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.472 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -64.19 -45.23 89.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.791 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 23.1 mt -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.741 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 95.4 p -61.94 -38.49 88.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.357 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.57 -42.9 95.36 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -66.1 -67.32 0.45 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.761 0.315 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 315' ' ' ILE . . . . . 0.585 ' O ' ' N ' ' A' ' 317' ' ' ARG . 4.8 mt -53.02 -94.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 316' ' ' SER . . . . . 0.549 ' C ' ' O ' ' A' ' 315' ' ' ILE . 6.6 t 25.08 -88.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.914 0.388 . . . . 0.0 110.575 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 315' ' ' ILE . 55.4 ttp180 . . . . . 0 C--N 1.33 -0.256 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.661 ' N ' HD22 ' A' ' 26' ' ' ASN . 54.5 m-85 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.864 0.364 . . . . 0.0 110.726 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.488 HH12 HD22 ' A' ' 57' ' ' LEU . 90.0 mtm180 -93.75 6.01 49.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.364 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 10.0 tpt -144.88 130.07 18.58 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -60.95 -38.29 85.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.357 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.8 -47.97 81.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.569 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 25' ' ' LEU . 95.6 mt -61.5 -38.63 88.05 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.727 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.661 HD22 ' N ' ' A' ' 20' ' ' PHE . 29.6 m120 -64.18 -40.13 95.46 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.488 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -60.77 -49.58 76.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.74 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.469 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 3.6 mm? -61.92 -40.88 97.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.215 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 47.7 t-105 -61.84 -46.26 90.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.134 0.492 . . . . 0.0 110.423 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -57.59 -42.85 83.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.462 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -61.6 -42.78 99.36 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.99 -44.69 87.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.162 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.172 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -60.2 -43.48 95.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.142 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.9 mt -65.01 -36.87 85.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.261 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.85 110.37 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.741 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.8 mt -127.33 155.81 75.87 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.806 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -40.94 154.42 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.535 2.157 . . . . 0.0 112.189 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.71 -47.14 26.88 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.548 2.165 . . . . 0.0 112.556 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.25 -45.08 97.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.412 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.539 ' O ' HD13 ' A' ' 45' ' ' LEU . 22.2 mmt85 -63.86 -40.59 96.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.53 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 tp -62.54 -43.71 98.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.529 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.98 89.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.412 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -67.9 -48.56 65.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 41' ' ' ARG . 8.1 mp -62.98 -45.46 92.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.646 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -63.8 -44.11 94.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.851 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.631 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.18 -48.73 80.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.071 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -57.43 -46.89 83.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.926 0.393 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.13 -40.84 86.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.917 0.389 . . . . 0.0 110.046 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.22 -39.91 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.088 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.631 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.9 mm -62.3 -43.78 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.054 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -58.62 -45.32 89.45 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.542 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.34 -47.01 87.03 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.128 0.489 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -64.16 -39.56 94.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.684 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.426 ' C ' ' OD1' ' A' ' 55' ' ' ASP . 60.4 t0 -60.56 -43.46 97.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.597 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -61.72 -43.88 97.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.033 0.444 . . . . 0.0 110.135 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.488 HD22 HH12 ' A' ' 21' ' ' ARG . 52.1 tp -60.5 -41.74 94.91 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.199 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.3 99.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.605 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.8 -42.41 93.36 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.342 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -61.08 -45.45 94.67 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -57.84 -44.02 86.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.179 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.9 mt -61.92 -42.11 98.72 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.139 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -56.26 -47.05 79.3 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.27 -0.572 . . . . 0.0 109.639 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.946 178.991 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.79 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -64.31 -35.13 79.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.701 0.286 . . . . 0.0 110.275 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.409 ' O ' HD13 ' A' ' 77' ' ' LEU . 65.7 mttm -58.04 -59.8 4.72 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.129 0.49 . . . . 0.0 110.162 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -55.57 -41.48 73.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.283 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.685 ' HB1' ' NH1' ' A' ' 79' ' ' ARG . . . -61.2 -38.67 87.37 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.352 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -62.49 -42.94 99.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 73' ' ' LYS . 10.2 mp -62.47 -43.08 99.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.49 -47.52 91.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.215 0.531 . . . . 0.0 110.134 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.685 ' NH1' ' HB1' ' A' ' 75' ' ' ALA . 77.3 mtt85 -61.21 -41.22 96.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.218 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.436 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.58 -49.26 78.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.082 0.468 . . . . 0.0 110.346 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.07 -38.54 88.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 79' ' ' ARG . 48.1 t -62.14 -47.05 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.636 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.8 -49.35 84.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.436 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 85' ' ' LEU . 13.7 tp -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.035 0.445 . . . . 0.0 110.724 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.84 93.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.849 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -61.63 -48.38 81.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.435 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -76.25 -16.31 59.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.12 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 58.51 38.42 91.03 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 90' ' ' LEU . 39.5 mt . . . . . 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 110.547 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.0 mt . . . . . 0 N--CA 1.462 0.136 0 CA-C-O 120.863 0.363 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.434 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 39.6 mt-10 -58.44 -42.2 86.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.8 mttt -60.16 -42.55 95.16 Favored 'General case' 0 C--N 1.318 -0.761 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.435 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.4 mt -64.4 -47.44 79.18 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.068 0.461 . . . . 0.0 111.773 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.635 ' CZ2' HD13 ' A' ' 135' ' ' LEU . 10.2 t-105 -64.24 -44.78 90.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.592 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.434 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 4.1 m80 -69.24 -34.98 75.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.745 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.554 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.4 mptt -60.25 -51.2 70.58 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.232 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -74.57 -46.31 39.63 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.722 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.45 ' HB2' HD11 ' A' ' 135' ' ' LEU . 62.9 tttp -53.21 -44.26 67.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.311 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -102.68 -60.08 1.6 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.935 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -61.65 -6.21 2.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.787 -178.986 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -135.65 4.41 4.0 Favored Glycine 0 C--N 1.329 0.174 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.486 ' CG ' ' O ' ' A' ' 128' ' ' GLY . 19.0 ptpt 43.44 21.09 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.17 0.509 . . . . 0.0 109.84 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.495 ' N ' ' O ' ' A' ' 128' ' ' GLY . 32.8 m-85 -78.78 50.75 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.586 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.7 p -94.5 130.11 41.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 112.105 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.13 -98.72 1.33 Allowed Glycine 0 CA--C 1.534 1.267 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.869 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.446 ' HG2' ' H ' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -80.3 -43.64 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.049 -179.226 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 133' ' ' GLU . 67.8 mm-40 -64.96 -42.96 94.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.635 HD13 ' CZ2' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.79 -43.51 98.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.942 179.445 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -62.3 -39.29 92.51 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.952 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -60.41 -43.29 96.87 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.37 0.605 . . . . 0.0 109.852 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 134' ' ' GLU . 2.8 mm? -59.68 -43.84 93.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -36.92 85.65 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.013 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.55 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 88.7 mtt-85 -53.49 -41.51 66.33 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.542 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 0.4 OUTLIER -71.26 -43.36 67.36 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.853 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -58.47 -54.86 42.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.407 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.49 -38.91 89.04 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.309 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 1.8 m-70 -54.75 -42.79 72.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.613 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -66.31 -39.8 89.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.637 178.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -61.27 -47.25 86.87 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.379 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.8 pt-20 -71.49 -43.01 67.33 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.541 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.417 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 96.9 mttt -62.67 -44.13 97.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.797 0.332 . . . . 0.0 110.456 -179.578 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.9 t -64.4 -44.43 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.603 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.776 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -60.63 -39.58 88.75 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.43 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.81 -43.18 99.48 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.678 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.584 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 24.5 m-85 -65.45 -49.63 68.43 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.842 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -68.62 -42.26 78.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.023 0.44 . . . . 0.0 110.997 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 150' ' ' HIS . 73.2 t -63.03 -45.16 99.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.947 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.5 mt . . . . . 0 C--N 1.329 -0.316 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.761 179.904 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 . . . . . 0 C--O 1.231 0.103 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.517 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 8.5 mp -63.18 -41.06 99.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.459 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.546 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 67.5 mttm -67.35 -34.06 76.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.59 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 97.2 mt-10 -67.6 -50.28 58.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.584 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 10.6 ptmt -72.28 -44.7 62.39 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.358 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.769 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.95 -41.51 86.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.102 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.546 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -65.92 -36.88 84.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 55.6 m -61.56 -43.38 98.97 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.42 -44.12 97.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.849 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.439 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.3 m-20 -62.0 -42.05 98.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.582 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.477 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 14.9 mm100 -62.24 -38.59 89.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.381 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.4 -42.3 99.74 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 201' ' ' LEU . 18.3 mt -63.25 -41.97 99.12 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.235 179.058 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.498 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.1 OUTLIER -62.8 -36.64 83.8 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -63.92 -42.27 97.43 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.616 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.48 -39.43 90.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.409 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -62.04 -45.12 94.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.222 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.554 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.7 mtt180 -65.3 -36.58 84.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.16 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.51 -45.88 96.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.252 0.548 . . . . 0.0 110.279 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 80.6 p -72.37 -26.67 61.98 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.535 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -95.34 -14.58 23.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.513 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -146.11 -25.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.718 0.294 . . . . 0.0 111.109 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.518 0.271 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 220' ' ' GLU . 2.2 tm-20 . . . . . 0 N--CA 1.445 -0.695 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 59.3 mt-10 -87.26 148.97 46.05 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.163 176.218 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.75 81.93 1.27 Allowed 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.564 2.176 . . . . 0.0 112.146 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 175.98 -36.6 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.752 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.916 HG13 ' H ' ' A' ' 224' ' ' ILE . 1.5 p -68.92 -76.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.168 0.508 . . . . 0.0 110.698 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.916 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.2 mp -50.61 -26.65 4.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.132 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -67.01 -50.03 63.43 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.371 0.605 . . . . 0.0 109.943 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 12.3 tp -56.79 -37.41 71.1 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 44.8 m0 -63.96 -42.56 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.193 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 228' ' ' ASP . . . . . 0.507 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 97.1 m-20 -66.76 -18.44 65.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 1.7 mt -77.81 -44.61 26.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.061 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 232' ' ' SER . . . -36.68 -62.16 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.198 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.507 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 3.2 pt20 -38.39 -31.94 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.673 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.413 ' N ' ' O ' ' A' ' 230' ' ' ALA . 66.5 m -118.4 52.62 1.01 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.374 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -141.41 46.26 1.71 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 61.95 72.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.379 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 235' ' ' LEU . 20.0 mt -125.08 148.04 48.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.696 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 66.6 p -66.36 -165.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.463 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 237' ' ' ASP . . . . . 0.548 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 31.3 p-10 -95.84 -48.18 5.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 238' ' ' LYS . . . . . 0.548 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 97.9 mttt -62.58 -43.35 99.03 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.03 0.443 . . . . 0.0 110.675 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -64.68 -33.63 76.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.013 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.67 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -62.56 -43.49 98.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.306 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -65.12 -49.66 69.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.405 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.14 -39.91 91.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.089 0.471 . . . . 0.0 110.002 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.486 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.14 -44.11 93.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.103 179.033 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 244' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 244' ' ' ARG . 0.0 OUTLIER -60.03 -47.55 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.036 0.445 . . . . 0.0 110.193 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -65.62 -47.43 75.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.751 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -56.28 -50.94 69.93 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.495 0.664 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.6 mm? -63.43 -37.82 88.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.776 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.452 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 89.0 tttt -53.76 -45.38 70.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.391 0.615 . . . . 0.0 109.995 -179.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -67.48 -40.63 85.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.697 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -61.01 -48.98 79.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.638 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.452 ' CG ' ' O ' ' A' ' 248' ' ' LYS . 13.5 pt-20 -59.31 -38.16 79.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 252' ' ' ALA . . . . . 0.422 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -65.48 -38.17 88.98 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.521 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -62.9 -49.57 74.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.554 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 9.7 tt -64.97 -31.84 55.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.17 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -62.22 -46.36 89.22 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.214 0.53 . . . . 0.0 110.054 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.22 -42.48 99.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.973 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -56.42 -43.83 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.339 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -61.93 -40.79 96.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.118 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -57.03 -46.33 82.45 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.274 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -63.7 -37.4 87.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 261' ' ' GLN . . . . . 0.513 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 30.8 mm-40 -57.72 -48.72 78.79 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.35 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -62.28 -43.1 99.61 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.189 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -65.49 -35.42 80.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.973 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 39.4 tp -63.7 -43.85 95.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.42 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -64.21 -44.72 91.06 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.542 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.44 -42.93 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.089 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.61 87.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.361 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -62.02 -48.52 79.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -61.61 -46.69 88.78 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 110.66 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.78 -37.66 85.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.349 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 49.3 tp -61.82 -43.99 97.74 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -61.59 -43.0 99.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.41 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -72.13 -37.69 69.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.61 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -63.1 -37.12 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.862 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.7 -30.77 71.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.715 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 90.7 p -86.71 2.43 48.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.712 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 274' ' ' ALA . 9.5 p -60.74 -41.97 90.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.455 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.514 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 123.73 -57.45 0.65 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -96.74 111.35 23.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.803 0.335 . . . . 0.0 110.584 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -74.08 106.93 2.13 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -136.6 -21.08 1.32 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.311 . . . . 0.0 110.651 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -124.81 -4.22 7.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.705 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 283' ' ' VAL . . . . . 0.57 HG13 ' N ' ' A' ' 284' ' ' SER . 11.3 p -63.24 -46.04 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 284' ' ' SER . . . . . 0.57 ' N ' HG13 ' A' ' 283' ' ' VAL . 10.6 t -63.78 -49.34 73.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.075 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.53 -43.03 98.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.86 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 48.5 t -60.27 -44.56 95.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.52 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 287' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 290' ' ' HIS . 60.0 ttt85 -63.24 -41.05 99.04 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.228 0.537 . . . . 0.0 110.632 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -56.81 -57.51 12.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.252 0.548 . . . . 0.0 109.959 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.564 ' HD3' HD23 ' A' ' 292' ' ' LEU . 46.8 mmtt -64.54 -31.34 72.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.153 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 290' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 287' ' ' ARG . 52.0 t-80 -53.13 -49.93 65.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.29 -37.62 71.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.618 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.564 HD23 ' HD3' ' A' ' 289' ' ' LYS . 26.3 tp -61.46 -50.76 71.46 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.594 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.3 mp -63.82 -41.65 97.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.135 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.16 -40.46 97.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.323 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.69 -47.21 91.8 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -63.66 -37.45 87.39 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.51 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.513 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 8.3 m -60.23 -50.27 74.31 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.488 -179.202 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.41 -40.07 96.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.412 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -58.93 -45.47 90.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.358 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.46 -44.51 96.98 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.297 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.36 -43.56 84.74 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 302' ' ' TYR . . . . . 0.475 ' CE1' ' NZ ' ' A' ' 306' ' ' LYS . 49.3 t80 -62.25 -42.43 99.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.162 0.506 . . . . 0.0 110.489 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 303' ' ' THR . . . . . 0.454 HG22 ' ND1' ' A' ' 307' ' ' HIS . 17.2 m -60.48 -44.29 96.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.643 -179.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.31 -43.25 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.046 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.79 -49.44 76.61 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.045 0.45 . . . . 0.0 110.937 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 306' ' ' LYS . . . . . 0.475 ' NZ ' ' CE1' ' A' ' 302' ' ' TYR . 34.7 mmtm -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.805 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.454 ' ND1' HG22 ' A' ' 303' ' ' THR . 20.6 m80 -66.31 -31.25 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.921 179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.65 HD21 ' CG2' ' A' ' 223' ' ' VAL . 0.5 OUTLIER -61.12 -49.92 75.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.238 -179.706 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -69.71 -40.1 76.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.634 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -60.05 -51.17 70.76 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.885 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 311' ' ' LEU . 30.2 mt -63.25 -39.82 95.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.442 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.7 t -58.89 -43.41 90.94 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.685 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.9 -49.89 56.1 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 314' ' ' ARG . . . . . 0.741 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.93 -43.6 95.4 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.7 mm -64.34 -43.14 97.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.809 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 99.5 p -56.07 -34.55 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.864 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 14.3 tpp180 . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.493 -179.352 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.428 ' N ' HD22 ' A' ' 26' ' ' ASN . 64.3 m-85 . . . . . 0 N--CA 1.462 0.171 0 CA-C-O 121.022 0.439 . . . . 0.0 110.728 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp85 -77.4 -11.48 59.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.69 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -134.83 145.7 48.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 110.988 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.35 -33.65 76.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.722 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.4 ' O ' HD23 ' A' ' 28' ' ' LEU . 58.1 mttm -59.02 -47.23 85.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 109.887 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.467 ' N ' HD12 ' A' ' 25' ' ' LEU . 9.4 mp -64.13 -37.94 89.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.292 178.744 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.428 HD22 ' N ' ' A' ' 20' ' ' PHE . 20.1 m120 -63.79 -41.24 97.96 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.602 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -65.15 -45.12 86.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.107 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.409 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 1.6 mm? -63.36 -41.78 98.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.479 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -63.29 -47.81 80.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.09 0.472 . . . . 0.0 110.358 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.5 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 80.8 tt0 -60.83 -39.19 88.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.199 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -45.0 96.38 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.06 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -41.36 96.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -59.45 -40.05 85.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.027 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.5 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -64.57 -39.01 92.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.339 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.4 mt -63.54 -36.73 84.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.383 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 65.95 106.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.604 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -129.4 154.47 80.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.63 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 74.3 Cg_exo -43.95 153.77 0.28 Allowed 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.369 2.046 . . . . 0.0 112.528 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.4 Cg_exo -58.73 -41.05 67.31 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.681 2.254 . . . . 0.0 112.364 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.01 -49.12 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.852 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.74 -41.57 92.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.622 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -65.25 -42.36 93.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -51.71 64.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.176 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.01 -38.48 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.504 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.9 tp -62.16 -50.77 70.51 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.043 0.449 . . . . 0.0 110.621 -179.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -61.1 -40.82 95.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.21 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.615 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.29 -49.77 75.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.073 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -58.82 -46.03 88.58 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.996 0.427 . . . . 0.0 110.584 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.0 mt -59.93 -41.07 90.95 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -58.99 -38.79 80.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.145 178.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 47' ' ' ALA . 45.5 mm -62.16 -44.42 99.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -58.81 -43.96 90.69 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.606 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.97 -48.37 81.79 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.971 0.415 . . . . 0.0 110.453 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -60.25 -44.54 95.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.752 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.94 -40.66 94.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.505 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.07 -45.74 91.9 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 110.103 179.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.31 -42.97 99.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.966 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.83 96.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.557 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.2 t90 -58.52 -44.08 89.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.095 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.77 -46.5 90.21 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 120.624 -0.43 . . . . 0.0 109.914 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.11 -41.05 97.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.085 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.449 HD13 ' HZ2' ' A' ' 73' ' ' LYS . 79.7 mt -61.62 -41.2 97.14 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.45 -38.74 88.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.667 ' O ' HD23 ' A' ' 64' ' ' LEU . 3.1 tt . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.57 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.02 -40.69 91.29 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.573 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.449 ' HZ2' HD13 ' A' ' 62' ' ' LEU . 39.7 mtpt -62.49 -47.81 82.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.021 0.439 . . . . 0.0 110.362 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.99 -42.55 94.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.467 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.84 -40.28 94.77 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -62.25 -41.97 98.92 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.608 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.52 -43.8 96.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.444 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.77 -45.66 94.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.302 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.776 ' O ' HG23 ' A' ' 83' ' ' VAL . 92.1 mtt-85 -63.09 -41.29 99.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.992 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -64.03 -39.59 94.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.337 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.587 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -60.16 -51.39 69.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.901 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.436 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 60.7 t-20 -66.23 -38.91 89.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.705 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 79' ' ' ARG . 60.8 t -62.29 -47.46 92.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.691 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.9 -47.11 94.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.63 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 85' ' ' LEU . 11.6 tp -66.23 -41.11 90.51 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.638 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.59 -47.62 84.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.989 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -62.64 -44.8 95.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 110.404 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -63.65 -32.74 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.065 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 79.46 22.61 64.43 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.332 -0.157 0 CA-C-O 120.886 0.374 . . . . 0.0 110.338 -179.88 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.863 0.364 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -59.5 -44.02 93.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 20.3 pttp -60.6 -41.5 94.89 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.257 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.429 ' N ' ' CG ' ' A' ' 119' ' ' LYS . 11.8 mt -62.12 -44.92 95.59 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.638 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.578 ' CZ3' HD22 ' A' ' 135' ' ' LEU . 15.6 t-105 -61.76 -47.16 86.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.318 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 3.0 m80 -67.68 -38.9 84.34 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.125 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.545 ' O ' ' CB ' ' A' ' 127' ' ' SER . 12.9 tptt -58.58 -51.45 69.83 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.911 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.04 -45.75 63.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.649 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.407 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 65.0 tttm -48.33 -44.45 34.19 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 128' ' ' GLY . 23.3 m -107.08 -60.54 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.818 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.71 -8.87 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.898 -178.958 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.556 ' C ' ' H ' ' A' ' 130' ' ' PHE . . . -137.58 4.38 3.34 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 48.92 11.03 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.135 0.493 . . . . 0.0 109.786 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.556 ' H ' ' C ' ' A' ' 128' ' ' GLY . 24.3 m-85 -71.58 50.45 0.18 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.421 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.47 ' HA ' HD12 ' A' ' 135' ' ' LEU . 4.7 p -97.94 112.9 24.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 112.145 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.44 -98.37 0.62 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.711 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.465 ' CG ' ' N ' ' A' ' 134' ' ' GLU . 10.0 pt-20 -77.18 -44.0 31.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.839 0.352 . . . . 0.0 111.31 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.465 ' N ' ' CG ' ' A' ' 133' ' ' GLU . 79.5 mm-40 -66.08 -41.92 90.05 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.578 HD22 ' CZ3' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.07 -43.18 99.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.862 179.373 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.513 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.3 OUTLIER -62.31 -37.99 87.68 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.936 179.769 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.434 ' N ' ' OD1' ' A' ' 136' ' ' ASP . 36.2 mmtm -60.15 -44.15 95.2 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.981 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.6 mm? -60.64 -43.03 98.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.59 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.34 -34.84 79.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 177.104 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -58.5 -39.09 79.09 Favored 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.988 178.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.489 ' OE1' HD21 ' A' ' 204' ' ' LEU . 97.4 mt-10 -70.62 -44.29 67.51 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.995 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -58.91 -56.29 24.18 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.74 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.785 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 97.4 mt -60.82 -39.84 90.53 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.579 -0.448 . . . . 0.0 109.815 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -55.19 -41.28 71.75 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.479 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -63.87 -45.88 87.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.384 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.785 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 46.7 pttt -57.55 -45.75 84.74 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.549 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.533 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 77.8 mm-40 -68.91 -50.18 51.7 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -63.09 -44.32 96.04 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.975 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 1.2 p -64.88 -38.09 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.716 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.3 m170 -65.92 -41.26 91.63 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.228 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.38 -43.16 95.37 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.939 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.52 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 3.8 m-85 -61.88 -50.84 70.62 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.853 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -69.77 -44.05 70.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.307 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 150' ' ' HIS . 74.2 t -63.4 -46.9 94.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.922 -179.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 74.0 mt . . . . . 0 C--O 1.239 0.509 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.401 -179.807 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 . . . . . 0 CA--C 1.52 -0.178 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.721 HD23 ' HZ1' ' A' ' 193' ' ' LYS . 14.2 mt -61.73 -45.55 93.43 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.083 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 55.9 pttt -80.45 -34.28 36.12 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.582 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 42.7 tt0 -69.24 -42.89 75.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.026 -179.33 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.721 ' HZ1' HD23 ' A' ' 190' ' ' LEU . 10.1 pttm -74.34 -43.2 57.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.745 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -68.6 -40.01 80.65 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.873 -179.726 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.491 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.2 ptm180 -67.6 -39.62 84.78 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 75.5 p -60.49 -40.79 92.58 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -64.93 -43.42 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.894 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -62.58 -42.46 99.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.776 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -65.75 -32.29 73.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.081 178.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.02 -46.18 94.03 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 201' ' ' LEU . 28.9 mt -63.42 -42.02 98.72 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.028 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.59 -36.58 84.27 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -42.02 98.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.379 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.489 HD21 ' OE1' ' A' ' 141' ' ' GLU . 78.7 mt -61.62 -41.55 97.63 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -64.25 -42.48 96.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.024 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.696 ' O ' ' N ' ' A' ' 210' ' ' GLN . 15.4 mmm180 -65.32 -40.9 94.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.981 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.66 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.2 t -63.77 -45.38 97.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.043 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.9 p -67.85 -28.19 67.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.762 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -101.66 -14.67 17.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.61 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.696 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.6 tt0 -131.59 -28.2 1.86 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.86 0.362 . . . . 0.0 111.107 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.66 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.52 0.382 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.401 ' O ' ' CD ' ' A' ' 219' ' ' GLU . 8.4 tm-20 . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -60.74 155.59 50.65 Favored Pre-proline 0 N--CA 1.464 0.235 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.203 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 31.7 Cg_exo -57.12 119.32 6.51 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 C-N-CA 122.149 1.9 . . . . 0.0 112.051 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 63.2 ttm-85 178.63 -93.58 0.0 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.757 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.559 HG11 HD22 ' A' ' 308' ' ' LEU . 0.2 OUTLIER -60.55 -47.16 93.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.733 -179.388 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.429 HD11 ' HE1' ' A' ' 250' ' ' PHE . 1.1 mp -65.41 -26.71 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.836 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -67.45 -46.54 72.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 109.767 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.566 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 5.0 tp -61.14 -41.27 96.43 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.354 179.302 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.469 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 44.2 m0 -60.06 -42.01 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.066 -0.653 . . . . 0.0 109.677 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -65.06 -29.84 70.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 4.0 mt -62.2 -43.26 99.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.872 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.932 ' O ' HD21 ' A' ' 235' ' ' LEU . . . -36.07 -42.91 0.31 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.919 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -39.53 -34.24 0.21 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.855 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 39.3 m -130.87 66.14 1.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.532 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 233' ' ' ALA . . . . . 0.936 ' H ' HD11 ' A' ' 235' ' ' LEU . . . -144.2 46.7 1.42 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 58.9 t30 63.17 73.56 0.45 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.494 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.936 HD11 ' H ' ' A' ' 233' ' ' ALA . 0.3 OUTLIER -108.85 -160.32 0.72 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.095 0.474 . . . . 0.0 110.843 179.719 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.4 ' OG1' ' CD ' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -131.74 -146.97 0.3 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.746 -179.157 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -101.59 -66.17 0.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.814 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.35 -40.9 97.92 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.446 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 239' ' ' GLU . . . . . 0.409 ' HG3' ' H ' ' A' ' 239' ' ' GLU . 34.0 mt-10 -61.93 -35.38 78.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.884 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.683 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.15 -46.04 89.05 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.79 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -65.34 -44.81 86.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.473 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.27 -41.45 93.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 243' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.49 -44.67 93.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.724 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -58.76 -52.98 63.39 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 -178.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -64.96 -36.91 85.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.697 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -61.79 -45.0 95.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.359 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.488 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 1.9 mm? -63.34 -41.23 98.86 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.768 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.74 -39.81 90.08 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.888 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -63.96 -63.04 1.26 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 250' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 29.4 t80 -59.78 -45.23 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 0.0 110.924 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.488 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 53.1 tp10 -55.03 -41.58 71.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.15 80.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -59.92 -45.83 91.34 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.838 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 254' ' ' ILE . . . . . 0.468 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.4 tp -66.84 -42.42 89.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.919 179.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.34 -45.59 92.91 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.713 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.73 -41.58 99.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.29 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -43.45 81.04 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -61.58 -40.79 96.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.212 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 259' ' ' HIS . . . . . 0.513 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 79.7 t60 -58.96 -47.95 83.29 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.212 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -62.29 -37.04 83.97 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.344 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -58.61 -43.79 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -61.82 -46.92 87.38 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.805 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 263' ' ' GLN . . . . . 0.513 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.0 mp0 -63.39 -36.77 84.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.864 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 50.3 tp -61.66 -42.46 98.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.348 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -63.05 -46.8 85.8 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.74 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.6 mt -63.02 -42.98 98.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.965 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.81 83.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.084 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -62.18 -44.88 95.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.35 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -59.24 -46.84 87.42 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.048 0.451 . . . . 0.0 110.344 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -60.48 -40.38 91.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.345 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.4 ' CD2' ' OE2' ' A' ' 275' ' ' GLU . 5.4 tt -59.52 -44.11 93.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -59.37 -44.48 92.73 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.995 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -67.63 -42.62 82.04 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.668 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 274' ' ' ALA . . . . . 0.637 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -60.7 -35.35 76.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.926 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 275' ' ' GLU . . . . . 0.4 ' OE2' ' CD2' ' A' ' 271' ' ' LEU . 90.7 mt-10 -61.31 -28.83 69.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.843 0.354 . . . . 0.0 110.447 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 97.1 p -89.1 5.91 42.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 277' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 274' ' ' ALA . 11.8 p -60.88 -44.2 97.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.702 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 278' ' ' GLY . . . . . 0.56 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 134.76 -86.67 0.25 Allowed Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -62.93 -39.96 96.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.721 0.296 . . . . 0.0 110.603 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 280' ' ' GLY . . . . . 0.578 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 87.91 -106.52 3.22 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 63.16 -53.8 0.19 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.851 0.358 . . . . 0.0 110.568 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 282' ' ' ARG . . . . . 0.578 ' N ' ' O ' ' A' ' 280' ' ' GLY . 16.4 ptm180 -72.26 -15.42 61.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.509 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.8 t -60.61 -44.95 97.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.43 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.1 t -59.97 -44.9 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.006 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -61.59 -43.21 99.29 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.025 0.44 . . . . 0.0 110.532 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 5.6 t -60.94 -42.35 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.093 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -61.67 -41.72 97.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.279 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -57.62 -53.74 54.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.262 -0.427 . . . . 0.0 109.895 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.445 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.1 mmtm -64.62 -34.36 78.09 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.211 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -58.21 -46.41 85.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.058 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.78 -40.36 79.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.913 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.699 ' O ' HD12 ' A' ' 292' ' ' LEU . 1.3 tp -62.92 -52.86 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.87 -43.28 99.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.149 0.5 . . . . 0.0 110.232 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.01 -36.54 84.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.88 -50.44 65.76 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 110.539 -1.025 . . . . 0.0 110.539 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -59.69 -41.28 90.36 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 5.9 m -59.45 -49.15 78.92 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 120.962 0.41 . . . . 0.0 110.04 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -63.72 -44.29 94.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -57.74 -40.22 79.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.03 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.24 -43.14 99.49 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.855 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.95 -43.4 94.93 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -61.88 -44.45 96.79 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.095 0.474 . . . . 0.0 110.778 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.5 m -60.07 -43.7 95.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.206 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.4 -44.24 92.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.924 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.78 -54.66 43.81 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.076 -179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -62.98 -41.69 99.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.46 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.696 ' NE2' HD13 ' A' ' 311' ' ' LEU . 5.3 t-160 -61.68 -39.15 90.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.047 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.559 HD22 HG11 ' A' ' 223' ' ' VAL . 26.0 mt -60.66 -44.55 96.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.439 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 309' ' ' GLN . . . . . 0.598 ' N ' ' OE1' ' A' ' 309' ' ' GLN . 0.0 OUTLIER -63.12 -49.31 74.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.592 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -63.03 -68.88 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.158 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.696 HD13 ' NE2' ' A' ' 307' ' ' HIS . 1.8 tp -41.68 -46.4 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.704 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 56.6 m -60.02 -41.8 92.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.514 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.59 -35.96 92.57 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 314' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 315' ' ' ILE . 18.1 mmm180 -73.54 -64.69 0.94 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.829 0.314 . . . . 0.0 110.977 -179.652 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 315' ' ' ILE . . . . . 0.721 HG22 ' N ' ' A' ' 316' ' ' SER . 0.8 OUTLIER -40.59 -104.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.228 -179.071 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 316' ' ' SER . . . . . 0.721 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.0 OUTLIER 62.37 -5.27 0.18 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.583 ' H ' ' C ' ' A' ' 315' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.372 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 . . . . . 0 C--O 1.234 0.267 0 CA-C-O 120.658 0.266 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -64.48 -36.8 85.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.82 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.6 mmm -118.56 148.75 42.33 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.21 0.529 . . . . 0.0 110.788 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.67 -38.12 88.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.694 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.29 -47.59 83.16 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.185 0.517 . . . . 0.0 110.321 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.9 tp -63.14 -38.59 91.78 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.501 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -64.24 -40.02 95.15 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.379 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.7 tp60 -62.81 -42.21 99.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.163 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -62.08 -44.4 96.74 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.016 0.436 . . . . 0.0 109.95 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -60.51 -49.57 77.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.362 0.601 . . . . 0.0 110.385 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -58.22 -38.54 77.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.279 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 tppt? -60.61 -46.06 91.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.179 0.514 . . . . 0.0 110.235 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.46 91.91 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.006 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -58.58 -38.64 78.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.194 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.571 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 62.8 ttm-85 -62.47 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.45 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.512 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.571 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 63.7 m-70 66.0 113.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.7 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 mt -137.45 154.99 75.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.858 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -43.31 155.1 0.16 Allowed 'Trans proline' 0 C--N 1.311 -1.434 0 C-N-CA 122.657 2.238 . . . . 0.0 112.12 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -65.43 -34.78 42.21 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.648 2.232 . . . . 0.0 112.094 -179.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.41 HG22 ' H ' ' A' ' 40' ' ' VAL . 3.0 m -68.02 -47.94 76.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.673 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.408 ' H ' HG23 ' A' ' 40' ' ' VAL . 96.9 mtt180 -66.87 -40.06 87.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.416 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.28 -44.09 97.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.501 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.58 -45.53 90.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.431 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.7 tp10 -66.72 -42.76 85.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.502 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.88 -49.55 74.38 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.728 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -58.94 -40.54 84.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.053 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.66 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.36 -48.82 80.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.682 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.11 -49.31 72.06 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.539 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.6 mt -58.59 -40.62 83.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.145 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.27 -37.37 80.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.981 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.9 mm -63.23 -43.44 98.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.792 179.477 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -57.14 -45.76 83.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.165 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.94 -49.9 76.08 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.263 0.554 . . . . 0.0 110.133 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -59.53 -44.77 93.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.457 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -61.41 -37.54 83.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -58.45 -47.93 82.38 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.007 0.432 . . . . 0.0 109.864 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 57' ' ' LEU . 32.0 mt -60.75 -42.01 96.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.211 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.25 -48.2 82.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.428 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -56.8 -39.28 73.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.253 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm -59.86 -46.64 88.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -60.6 -45.51 93.71 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.471 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.15 -39.55 92.99 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.99 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -58.66 -42.97 89.66 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.735 HD13 ' O ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.832 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.56 -38.94 86.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.755 0.312 . . . . 0.0 110.332 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.599 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 55.4 mttp -56.78 -57.57 11.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.004 0.43 . . . . 0.0 110.154 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -53.2 -39.14 63.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.183 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.85 -40.25 92.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.272 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.599 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 88.0 mtm180 -63.35 -39.26 94.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.58 -44.5 93.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -47.24 89.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.381 0.61 . . . . 0.0 110.224 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.615 ' O ' HG23 ' A' ' 83' ' ' VAL . 2.9 ttt180 -61.44 -41.93 97.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.119 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.49 ' O ' HG13 ' A' ' 84' ' ' ILE . 8.2 t-20 -61.25 -41.03 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.257 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.688 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.75 -48.69 80.68 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.191 0.52 . . . . 0.0 110.06 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.75 -39.13 87.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.578 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.2 t -63.52 -45.98 96.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.411 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -60.43 -49.01 86.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.354 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.73 -42.82 85.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.965 0.412 . . . . 0.0 111.069 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.62 -45.82 92.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.549 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.66 -47.46 83.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.602 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.83 -22.35 66.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.128 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 77.15 19.81 76.48 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 90' ' ' LEU . 43.8 mt . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.816 0.341 . . . . 0.0 110.422 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.2 mt . . . . . 0 C--O 1.234 0.266 0 CA-C-O 121.005 0.431 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.05 -34.65 75.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.619 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 71.3 mmtt -59.91 -44.07 94.48 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.468 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.12 -44.44 72.39 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.885 0.374 . . . . 0.0 111.69 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.6 ' CZ3' HD22 ' A' ' 135' ' ' LEU . 16.4 t-105 -61.57 -46.69 88.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.847 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -68.57 -37.61 80.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.768 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.7 OUTLIER -57.31 -51.92 67.42 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.898 -178.543 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.438 ' HB1' ' HB2' ' A' ' 130' ' ' PHE . . . -73.32 -45.99 52.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.999 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.501 ' HB2' HD11 ' A' ' 135' ' ' LEU . 62.1 tttm -48.54 -44.19 36.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.84 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.8 m -108.62 -63.46 1.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.907 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -54.89 -11.73 0.68 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.598 -178.725 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.56 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -131.76 -3.09 4.19 Favored Glycine 0 CA--C 1.519 0.301 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' SER . 46.5 mttp 54.69 8.71 0.23 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.223 0.535 . . . . 0.0 109.848 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' PHE . . . . . 0.56 ' CD1' ' O ' ' A' ' 128' ' ' GLY . 14.2 m-30 -67.82 51.19 0.06 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.821 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.553 ' HA ' HD12 ' A' ' 135' ' ' LEU . 96.8 p -97.63 112.29 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.762 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.403 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.94 -97.93 0.59 Allowed Glycine 0 CA--C 1.528 0.871 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.299 178.241 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.7 mm-40 -77.74 -44.01 29.11 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.042 -179.135 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.4 mp0 -65.6 -43.87 88.35 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.529 -0.469 . . . . 0.0 109.9 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.6 HD22 ' CZ3' ' A' ' 121' ' ' TRP . 0.6 OUTLIER -62.04 -41.4 98.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.886 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -63.67 -36.93 85.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.945 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.2 mttt -63.0 -44.1 96.95 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.418 0.628 . . . . 0.0 110.057 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.02 -42.55 94.59 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -66.07 -37.83 86.79 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.619 -0.718 . . . . 0.0 112.687 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.547 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 0.6 OUTLIER -51.85 -41.64 62.0 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.766 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 0.7 OUTLIER -70.22 -42.42 72.32 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.539 178.672 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.41 -52.85 63.86 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.209 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.539 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.5 mm? -61.96 -40.64 96.26 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.307 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.547 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 45.2 m170 -53.55 -44.99 69.69 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.474 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.497 ' CD2' HG23 ' A' ' 197' ' ' ILE . 5.5 m80 -63.83 -41.63 97.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.572 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.6 mmmt -60.27 -41.47 93.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.159 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' GLU . . . . . 0.472 ' HA ' ' ND1' ' A' ' 150' ' ' HIS . 50.5 mt-10 -70.2 -55.49 9.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.558 -179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -63.52 -44.21 94.93 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.406 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.523 ' CG1' ' N ' ' A' ' 150' ' ' HIS . 2.8 p -60.83 -44.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.438 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' HIS . . . . . 0.696 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 1.2 p-80 -66.15 -33.71 76.4 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.324 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' GLU . . . . . 0.609 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 91.7 mt-10 -63.33 -39.94 95.94 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.313 -0.555 . . . . 0.0 109.892 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -61.93 -49.4 76.32 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.084 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -68.64 -43.78 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 19.3 t -60.75 -45.07 98.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.096 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.4 mt . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.539 -179.477 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 . . . . . 0 CA--C 1.52 -0.185 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 0.8 OUTLIER -60.98 -45.25 95.55 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.718 179.367 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 191' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 63.3 mttp -70.15 -36.1 74.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 192' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 2.9 tm-20 -68.06 -47.9 67.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.059 0.457 . . . . 0.0 111.741 -178.581 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.469 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 15.8 pttt -73.13 -41.61 63.78 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.416 -179.219 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.757 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.67 -41.11 79.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.063 -179.59 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 195' ' ' ARG . . . . . 0.535 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 36.1 ptt180 -67.57 -39.12 84.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 67.4 m -58.64 -42.38 88.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 197' ' ' ILE . . . . . 0.497 HG23 ' CD2' ' A' ' 145' ' ' HIS . 91.2 mt -64.14 -43.64 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.429 178.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -61.1 -40.92 95.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.415 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 199' ' ' GLN . . . . . 0.504 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 94.7 mt-30 -60.51 -40.31 90.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.52 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.6 -41.48 99.58 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 197' ' ' ILE . 1.4 mm? -63.24 -41.17 99.04 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.155 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 202' ' ' ASP . . . . . 0.551 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.2 OUTLIER -62.61 -37.39 86.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.41 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 203' ' ' ARG . . . . . 0.459 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 8.0 tmm_? -61.46 -43.85 98.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.731 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.1 mt -61.67 -40.26 94.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -64.85 -42.04 95.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.126 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.744 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -61.43 -45.33 94.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.366 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 207' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.296 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 89.3 p -61.89 -37.33 84.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.543 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -94.33 -43.09 8.57 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.102 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 210' ' ' GLN . . . . . 0.744 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.6 tt0 -87.05 -42.92 12.7 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 211' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.43 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 220' ' ' GLU . 11.3 tm-20 . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 121.115 0.483 . . . . 0.0 110.292 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 220' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 0.0 OUTLIER 54.78 169.91 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.988 -179.878 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 221' ' ' PRO . . . . . 0.557 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 41.4 Cg_exo -55.85 150.86 43.57 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.461 2.107 . . . . 0.0 112.025 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 222' ' ' ARG . . . . . 0.715 ' O ' ' N ' ' A' ' 225' ' ' ASP . 24.1 ttp180 87.51 -139.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.493 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 223' ' ' VAL . . . . . 0.527 HG23 ' H ' ' A' ' 224' ' ' ILE . 2.5 m 27.77 -104.17 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.207 0.527 . . . . 0.0 110.72 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.527 ' H ' HG23 ' A' ' 223' ' ' VAL . 1.3 mp -59.78 -39.05 78.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.787 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 225' ' ' ASP . . . . . 0.715 ' N ' ' O ' ' A' ' 222' ' ' ARG . 55.9 m-20 -62.53 -40.66 97.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.8 tp -60.0 -43.56 95.11 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.338 0.59 . . . . 0.0 109.491 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 227' ' ' TRP . . . . . 0.433 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 26.0 m0 -63.14 -33.95 76.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.695 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -61.42 -38.95 88.98 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 229' ' ' LEU . . . . . 0.513 ' O ' ' N ' ' A' ' 232' ' ' SER . 97.8 mt -63.44 -42.1 98.66 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.787 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 230' ' ' ALA . . . . . 0.498 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -28.3 -44.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.955 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 231' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 229' ' ' LEU . 62.9 tt0 -67.33 -53.56 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.719 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 232' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 229' ' ' LEU . 30.2 t -68.61 -18.1 64.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.5 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -69.02 -82.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.657 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -177.6 98.81 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.631 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 235' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 235' ' ' LEU . 53.4 mt -145.09 151.62 38.79 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.1 p -79.62 169.25 18.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.691 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -61.38 -48.24 82.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.829 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -60.28 -49.29 78.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.99 0.424 . . . . 0.0 110.817 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.24 -37.52 85.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.675 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.78 -40.57 95.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.43 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.95 -55.6 31.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.612 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -59.39 -37.13 77.19 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.776 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 243' ' ' PHE . . . . . 0.583 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.4 OUTLIER -63.33 -45.92 89.02 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.938 178.827 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 244' ' ' ARG . . . . . 0.445 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 45.0 ttm180 -60.91 -45.02 96.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.071 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -65.93 -46.56 77.78 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 51.8 tp10 -59.67 -47.42 85.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.583 HD23 ' O ' ' A' ' 243' ' ' PHE . 2.4 mm? -63.73 -39.39 94.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.798 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 86.5 tttt -54.81 -48.1 73.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.165 0.507 . . . . 0.0 110.115 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -67.74 -37.96 82.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -61.05 -49.56 76.88 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.833 0.349 . . . . 0.0 111.066 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 251' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 16.1 pt-20 -62.41 -35.4 79.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.894 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.11 92.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.386 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.29 -50.78 68.76 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.978 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -30.36 49.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.176 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -64.54 -46.39 83.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 110.172 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -62.89 -44.45 96.06 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.349 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -57.61 -42.99 84.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.253 179.469 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -61.15 -40.79 95.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.133 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 259' ' ' HIS . . . . . 0.533 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 81.9 t60 -59.43 -47.08 86.86 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.27 0.557 . . . . 0.0 110.279 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -62.44 -36.23 81.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.371 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 21.1 mm100 -61.71 -42.37 98.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.214 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -60.62 -47.66 85.21 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 263' ' ' GLN . . . . . 0.533 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 3.7 mp0 -65.78 -37.67 86.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.166 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.73 -43.5 98.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.248 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -62.81 -48.93 76.99 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.13 0.49 . . . . 0.0 110.424 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 70.3 mt -62.3 -43.0 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.901 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.54 76.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -63.88 -49.29 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.279 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.75 -44.03 82.53 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.037 0.446 . . . . 0.0 110.672 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -62.39 -45.75 91.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.572 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.54 HD13 ' CB ' ' A' ' 286' ' ' SER . 42.8 tp -62.05 -42.46 99.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.785 0.326 . . . . 0.0 110.344 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -57.25 -42.8 82.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.277 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -80.14 -26.92 39.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.528 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.55 -38.14 90.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.735 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -53.73 -20.91 6.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.548 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 73.5 m -62.37 -37.18 84.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.73 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.0 t -61.01 -45.22 98.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.49 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 98.74 17.78 27.24 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 279' ' ' ASP . . . . . 0.424 ' O ' HG23 ' A' ' 283' ' ' VAL . 99.8 m-20 -82.5 106.63 14.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.823 0.344 . . . . 0.0 110.462 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.21 91.8 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -61.63 -53.93 49.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.769 0.319 . . . . 0.0 110.632 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -68.2 -43.88 77.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.778 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 283' ' ' VAL . . . . . 0.577 ' CG1' ' NH1' ' A' ' 287' ' ' ARG . 41.8 t -61.85 -48.28 89.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.701 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 42.9 t -62.99 -46.04 89.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.777 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -63.25 -41.33 99.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.788 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 286' ' ' SER . . . . . 0.54 ' CB ' HD13 ' A' ' 271' ' ' LEU . 55.4 m -59.64 -45.3 92.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.398 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 287' ' ' ARG . . . . . 0.577 ' NH1' ' CG1' ' A' ' 283' ' ' VAL . 59.6 mtt85 -64.03 -38.16 90.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.975 0.417 . . . . 0.0 110.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -57.76 -60.98 2.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.393 0.616 . . . . 0.0 110.238 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 289' ' ' LYS . . . . . 0.513 ' HD3' HD23 ' A' ' 292' ' ' LEU . 4.9 mmtp -63.34 -40.46 97.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.043 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -42.62 -52.49 4.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.182 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.09 -37.63 78.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.677 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 292' ' ' LEU . . . . . 0.513 HD23 ' HD3' ' A' ' 289' ' ' LYS . 22.8 tp -61.41 -52.28 65.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.587 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.83 -42.05 97.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.251 0.548 . . . . 0.0 109.991 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 294' ' ' GLU . . . . . 0.502 ' O ' ' OG1' ' A' ' 297' ' ' THR . 82.3 tt0 -62.25 -35.34 78.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.695 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.47 -44.81 94.69 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -59.58 -43.48 93.63 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.09 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 297' ' ' THR . . . . . 0.502 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 36.0 p -60.5 -42.19 95.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.243 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -63.73 -45.12 91.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.434 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -60.92 -44.15 97.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.305 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -42.74 99.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.962 0.411 . . . . 0.0 110.429 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.28 -43.23 95.66 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -62.15 -42.86 99.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.399 . . . . 0.0 110.449 178.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 10.5 m -61.25 -44.96 96.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.482 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.56 -43.27 90.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.972 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -59.33 -49.6 77.2 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.626 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -62.9 -43.56 98.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.341 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 307' ' ' HIS . . . . . 0.538 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.58 -37.05 85.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.138 179.321 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 308' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 312' ' ' SER . 11.8 mt -61.34 -41.87 97.75 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.436 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -68.52 -58.84 3.71 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.05 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.11 -48.79 78.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.265 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 311' ' ' LEU . . . . . 0.561 HD12 ' NH2' ' A' ' 314' ' ' ARG . 12.4 tp -61.0 -42.78 99.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.703 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 312' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 67.2 p -61.67 -36.11 79.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.519 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.26 -44.96 89.69 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 314' ' ' ARG . . . . . 0.561 ' NH2' HD12 ' A' ' 311' ' ' LEU . 87.0 mtm180 -63.2 -43.46 98.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.738 0.304 . . . . 0.0 110.855 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 315' ' ' ILE . . . . . 0.442 ' O ' HG22 ' A' ' 315' ' ' ILE . 2.1 mm -74.09 -15.79 16.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.692 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 6.1 t -53.49 -48.65 68.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.262 0.553 . . . . 0.0 109.726 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.76 -176.867 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 88.0 t80 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 t -61.27 -44.09 97.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.069 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 54.5 ttm-85 55.31 78.39 0.19 Allowed 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.648 ' O ' ' N ' ' A' ' 6' ' ' ASN . 96.7 mt-10 -61.99 -32.96 73.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.894 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.6 tttp 48.26 -79.08 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.602 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.648 ' N ' ' O ' ' A' ' 4' ' ' GLU . 16.3 p30 -149.83 166.81 28.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.648 0.261 . . . . 0.0 110.375 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -176.36 58.75 0.17 Allowed Pre-proline 0 N--CA 1.463 0.179 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.769 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.63 148.18 92.41 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 122.367 2.045 . . . . 0.0 111.915 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.5 tttt -171.24 56.55 0.24 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.594 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.22 155.87 63.45 Favored 'Trans proline' 0 C--N 1.308 -1.593 0 C-N-CA 122.655 2.237 . . . . 0.0 112.08 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.7 p -45.72 142.72 3.44 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.684 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.13 149.7 36.56 Favored 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 122.694 2.262 . . . . 0.0 112.043 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -139.16 147.64 42.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.438 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 40.88 80.37 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.063 0.459 . . . . 0.0 110.68 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -73.63 2.46 8.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.441 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 30.9 p -154.26 160.22 41.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.611 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 175.42 175.83 43.18 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.936 -0.865 . . . . 0.0 110.936 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -86.88 129.31 34.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.788 0.328 . . . . 0.0 110.529 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -89.02 -64.69 1.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.784 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -93.81 153.35 18.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.52 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.485 ' C ' ' SD ' ' A' ' 22' ' ' MET . 73.2 ttp85 -67.77 -18.68 64.95 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.525 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.486 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -115.32 137.14 52.35 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.206 0.526 . . . . 0.0 111.102 -179.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.94 -36.49 84.55 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.474 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -60.72 -47.35 86.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.106 0.479 . . . . 0.0 110.26 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.7 mp -61.77 -38.25 87.35 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.486 ' ND2' ' O ' ' A' ' 22' ' ' MET . 57.7 m-80 -62.32 -40.69 97.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.972 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 82.0 mt-30 -60.84 -45.7 93.48 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.722 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.22 -41.03 96.15 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.032 0.444 . . . . 0.0 109.973 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -57.96 -44.71 87.2 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.121 0.486 . . . . 0.0 109.787 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -60.48 -37.46 81.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.616 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 73.5 mmtt -61.38 -42.53 98.87 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.255 0.55 . . . . 0.0 109.678 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.72 -37.31 86.05 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.149 -0.621 . . . . 0.0 110.113 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -61.15 -46.37 90.82 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.254 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.616 ' HG2' ' O ' ' A' ' 31' ' ' LYS . 53.6 ptt85 -66.19 -35.1 79.57 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.119 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.36 -38.63 91.91 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.051 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.77 110.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.707 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 mt -132.69 154.59 81.54 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.741 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 79.0 Cg_exo -42.54 154.3 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.415 2.077 . . . . 0.0 112.487 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.1 Cg_exo -58.12 -46.86 22.87 Favored 'Trans proline' 0 N--CA 1.497 1.73 0 C-N-CA 122.615 2.21 . . . . 0.0 112.51 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.472 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 62.2 t -64.14 -46.46 93.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.726 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -64.06 -41.86 97.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.133 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.97 -44.2 97.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.61 90.47 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.71 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.472 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 1.7 mp0 -67.73 -46.94 70.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.84 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.533 HD13 ' OH ' ' A' ' 88' ' ' TYR . 55.6 tp -63.16 -46.92 84.91 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.023 0.44 . . . . 0.0 110.489 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 46.4 t60 -59.27 -42.32 90.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.05 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.578 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.62 -47.64 84.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.939 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -56.01 -47.13 78.34 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.68 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.32 -40.86 87.61 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -59.4 -39.34 83.1 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.842 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 47' ' ' ALA . 40.6 mm -62.33 -43.7 98.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -55.5 -44.71 76.84 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.267 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -60.08 -46.53 89.28 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.088 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -60.66 -44.48 96.38 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.364 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -61.07 -37.45 82.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.311 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -60.44 -45.1 94.89 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.26 -42.01 97.9 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.213 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.54 94.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.014 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -58.6 -43.53 89.59 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.759 0.314 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -60.2 -46.57 89.26 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.012 0.434 . . . . 0.0 110.044 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.79 -39.57 94.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.786 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.6 mt -61.57 -43.17 99.36 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.27 -37.02 85.99 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.13 -44.91 96.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.907 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.47 -36.84 85.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.134 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.63 71.56 0.99 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 88.4 mt -131.75 -54.14 1.0 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.757 0.313 . . . . 0.0 110.814 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 48.6 p-10 -58.58 141.36 52.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.453 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -148.17 -49.78 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.621 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -65.51 -29.38 70.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.55 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.99 11.82 80.68 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.681 -0.967 . . . . 0.0 110.681 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -64.05 -34.75 78.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.37 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.1 -50.1 75.35 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.088 0.47 . . . . 0.0 109.857 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -61.4 -41.89 97.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.188 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.23 89.85 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.382 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -62.5 -42.74 99.71 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.642 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.16 -43.45 98.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.522 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.9 -44.53 98.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 121.094 0.473 . . . . 0.0 109.966 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.758 ' O ' HG23 ' A' ' 83' ' ' VAL . 20.7 mmm180 -59.87 -41.12 90.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.098 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.78 -39.34 94.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.39 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.43 -49.14 78.95 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.39 -179.58 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -64.31 -39.02 93.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.512 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 79' ' ' ARG . 70.7 t -62.18 -46.21 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.835 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.7 mt -61.53 -47.66 92.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.183 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.3 -39.63 92.74 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.648 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.49 93.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.545 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.66 -44.54 96.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.693 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.533 ' OH ' HD13 ' A' ' 45' ' ' LEU . 12.2 m-85 -69.49 -26.0 64.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.32 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.03 28.07 71.05 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 85.4 mt -96.59 6.62 48.34 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.898 0.38 . . . . 0.0 110.68 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -73.25 54.9 0.43 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.225 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.57 140.78 23.04 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -150.26 151.75 33.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.699 0.285 . . . . 0.0 110.625 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -139.52 146.69 40.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.318 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -69.19 141.78 54.44 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.414 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.41 ' O ' ' O ' ' A' ' 97' ' ' ARG . . . -164.3 -47.6 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.71 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.41 ' O ' ' O ' ' A' ' 96' ' ' ALA . 59.6 ttm-85 45.91 96.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.641 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -53.09 165.34 0.32 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.778 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 74.3 t -61.95 -45.38 98.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.442 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.438 HG22 ' H ' ' A' ' 100' ' ' THR . 0.0 OUTLIER -80.74 160.09 25.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.557 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.7 t -155.09 155.69 34.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.562 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.414 ' C ' ' N ' ' A' ' 104' ' ' LEU . 88.7 m-20 -62.83 -41.23 99.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.529 ' OG ' ' O ' ' A' ' 103' ' ' SER . 0.3 OUTLIER 45.51 21.32 0.07 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.978 0.418 . . . . 0.0 110.436 179.684 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.475 HD13 ' C ' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -76.96 -72.02 0.37 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.76 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.4 ' O ' ' O ' ' A' ' 104' ' ' LEU . 0.7 OUTLIER 60.11 145.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.692 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 161.18 66.34 0.02 OUTLIER Glycine 0 CA--C 1.523 0.592 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.7 t -140.08 -171.77 3.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.85 0.357 . . . . 0.0 110.527 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -62.68 136.27 57.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.876 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -85.54 126.57 33.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.282 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -149.03 159.73 43.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.608 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -171.07 -69.9 0.04 OUTLIER Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.487 HD12 ' HE1' ' A' ' 122' ' ' HIS . 27.6 mt -116.67 131.16 57.02 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.736 0.303 . . . . 0.0 110.234 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -122.19 -40.64 2.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.742 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -83.0 124.87 76.2 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.635 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -51.53 -38.37 64.43 Favored 'Trans proline' 0 N--CA 1.495 1.605 0 C-N-CA 122.367 2.045 . . . . 0.0 112.469 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.461 ' HG3' ' H ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.36 -42.65 96.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.948 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.461 ' H ' ' HG3' ' A' ' 116' ' ' ARG . 98.3 mt -64.93 -39.74 93.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.976 0.417 . . . . 0.0 110.227 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -62.13 -30.39 71.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.579 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.1 mttt -62.93 -50.45 70.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.747 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 120' ' ' LEU . 32.5 mt -68.08 -43.83 77.63 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.882 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.0 t-105 -60.41 -51.3 70.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 -179.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.487 ' HE1' HD12 ' A' ' 112' ' ' LEU . 5.4 m80 -70.08 -37.55 75.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.026 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.759 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.5 OUTLIER -55.45 -50.87 68.71 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.463 -178.877 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.95 ' HB1' ' CG ' ' A' ' 130' ' ' PHE . . . -72.5 -46.93 52.4 Favored 'General case' 0 C--O 1.246 0.886 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.288 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.404 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 55.8 tttm -47.15 -33.91 5.64 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.46 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -106.15 -35.43 7.22 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.986 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.576 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 36.9 m -50.72 -24.84 3.69 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.279 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -153.89 -95.8 0.12 Allowed Glycine 0 CA--C 1.525 0.703 0 C-N-CA 119.686 -1.245 . . . . 0.0 111.824 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.738 ' O ' ' N ' ' A' ' 131' ' ' SER . 68.8 mttm -150.93 25.27 0.74 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.372 0.605 . . . . 0.0 110.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.95 ' CG ' ' HB1' ' A' ' 124' ' ' ALA . 21.9 m-85 -49.72 60.82 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.186 -1.37 . . . . 0.0 111.14 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.738 ' N ' ' O ' ' A' ' 129' ' ' LYS . 30.3 p -70.1 146.44 50.89 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.446 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . -37.03 -18.56 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.178 -173.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.632 ' N ' ' O ' ' A' ' 131' ' ' SER . 48.8 mt-10 -74.31 -46.14 42.9 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 118.927 -1.109 . . . . 0.0 108.497 176.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' A' ' 131' ' ' SER . 80.4 mm-40 -75.62 -42.36 51.85 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.354 178.333 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.882 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -60.07 -37.47 79.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.446 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 54.5 m-20 -61.92 -43.94 97.8 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.362 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -58.92 -45.16 91.05 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 119.881 -0.727 . . . . 0.0 109.9 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.489 HD13 ' OE2' ' A' ' 141' ' ' GLU . 4.5 mm? -61.01 -40.37 93.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 178.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.591 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -65.12 -31.53 72.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 176.876 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.567 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 84.5 mmt-85 -57.6 -48.51 79.19 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.245 -0.982 . . . . 0.0 108.358 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.83 ' OE1' HD21 ' A' ' 204' ' ' LEU . 9.4 pt-20 -71.46 -34.16 69.98 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.964 -0.694 . . . . 0.0 111.912 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.591 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.2 m-85 -56.15 -58.78 6.48 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.184 0.516 . . . . 0.0 110.242 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.41 -37.59 86.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.214 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 67.4 m170 -51.51 -42.7 61.9 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 119.677 -0.809 . . . . 0.0 109.388 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.88 -41.67 91.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.396 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -61.29 -44.15 97.7 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.31 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -68.05 -49.19 62.9 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -61.37 -42.91 99.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.606 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.06 -45.09 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.542 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.689 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.4 m170 -61.12 -35.96 78.45 Favored 'General case' 0 C--O 1.215 -0.742 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.294 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -65.21 -46.68 79.69 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.191 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.416 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 42.1 m-85 -65.69 -44.02 87.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.837 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -70.44 -45.2 66.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.667 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 150' ' ' HIS . 75.9 t -63.12 -45.96 97.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.905 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.72 -43.74 95.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.42 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.08 -43.59 98.12 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.588 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' GLU . . . . . 0.449 ' O ' ' OG ' ' A' ' 160' ' ' SER . 79.5 mm-40 -67.6 -28.29 67.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.984 0.421 . . . . 0.0 110.037 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 63.0 m -67.88 -49.53 61.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.88 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.593 HD22 HH22 ' A' ' 186' ' ' ARG . 4.2 pp -79.33 -20.78 47.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.756 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.523 ' N ' HD12 ' A' ' 159' ' ' LEU . 80.4 p -60.44 -34.65 74.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.45 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.427 ' C ' ' H ' ' A' ' 163' ' ' GLU . 99.4 mtt180 -63.58 -40.75 97.75 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.101 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 11.5 p -75.49 39.73 0.16 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.643 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.427 ' H ' ' C ' ' A' ' 161' ' ' ARG . 71.3 mm-40 -127.02 -39.34 1.94 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.051 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.469 ' OE2' ' OE1' ' A' ' 167' ' ' GLU . 11.7 tp10 -89.94 23.48 2.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.157 0.504 . . . . 0.0 110.289 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.598 ' O ' HG23 ' A' ' 165' ' ' ILE . 18.8 tt -56.6 117.26 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.056 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 34.8 m170 54.1 23.57 4.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.366 0.603 . . . . 0.0 109.465 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.469 ' OE1' ' OE2' ' A' ' 164' ' ' GLU . 48.5 tp10 45.73 81.95 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.784 178.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.455 ' O ' HG13 ' A' ' 169' ' ' VAL . 80.6 m-20 -158.86 112.42 2.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.137 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 168' ' ' ASN . 6.0 m -154.48 75.14 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.76 0.314 . . . . 0.0 110.963 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 21.4 tt -172.34 135.42 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.548 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' SER . . . . . 0.599 ' O ' ' N ' ' A' ' 173' ' ' SER . 5.8 m -159.83 155.53 22.61 Favored Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.606 179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.55 65.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 122.545 2.163 . . . . 0.0 112.311 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.599 ' N ' ' O ' ' A' ' 171' ' ' SER . 16.7 m -145.32 123.79 12.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.754 0.311 . . . . 0.0 110.711 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.574 ' OD1' ' N ' ' A' ' 175' ' ' LEU . 46.6 p-10 -65.3 -37.23 86.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.413 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.574 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 0.9 OUTLIER -142.79 45.85 1.58 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.038 0.447 . . . . 0.0 109.938 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 6.2 m 57.66 -86.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.231 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.522 ' N ' ' OD1' ' A' ' 177' ' ' ASP . 13.1 p-10 174.64 123.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.675 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.438 ' N ' HD13 ' A' ' 178' ' ' ILE . 0.0 OUTLIER -126.81 128.4 70.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.833 0.349 . . . . 0.0 110.655 179.71 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -124.47 5.38 8.32 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.777 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.417 ' O ' HG23 ' A' ' 182' ' ' VAL . . . 109.05 126.7 5.37 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.807 ' N ' ' NE2' ' A' ' 184' ' ' HIS . 3.1 t 56.56 56.37 5.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.88 0.371 . . . . 0.0 110.189 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 180' ' ' GLY . 6.2 t -138.87 -85.13 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.92 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 50.6 tp -93.01 -48.25 6.6 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.975 0.417 . . . . 0.0 111.258 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.807 ' NE2' ' N ' ' A' ' 181' ' ' SER . 23.8 p80 -53.3 -39.43 63.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.204 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -43.92 96.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.583 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.593 HH22 HD22 ' A' ' 159' ' ' LEU . 3.7 tpt180 -61.21 -45.21 95.51 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.588 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 -61.72 -40.51 95.33 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.423 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 59.3 m -61.61 -44.22 97.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.174 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -63.06 -37.7 88.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.967 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.588 HD23 ' NZ ' ' A' ' 193' ' ' LYS . 8.5 mt -61.97 -47.85 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.592 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.465 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.7 mtpt -68.59 -40.88 80.32 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.438 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -68.76 -44.95 72.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.883 -178.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.588 ' NZ ' HD23 ' A' ' 190' ' ' LEU . 1.8 pttm -71.57 -44.46 64.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.233 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.701 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -69.36 -42.82 74.72 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.32 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.548 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.99 -37.56 88.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' ' 195' ' ' ARG . 69.3 m -62.18 -44.32 96.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -65.38 -43.71 94.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.983 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -63.06 -42.47 99.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.822 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -66.04 -33.12 75.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.334 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.95 -49.51 74.83 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 201' ' ' LEU . 23.0 mt -63.49 -40.46 97.15 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.961 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.8 -37.41 84.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -42.83 99.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.238 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.83 HD21 ' OE1' ' A' ' 141' ' ' GLU . 21.0 mt -61.51 -41.48 97.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -64.52 -42.94 95.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.803 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.711 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -65.99 -40.29 91.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.565 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.521 ' O ' ' N ' ' A' ' 211' ' ' GLY . 22.0 t -63.65 -46.82 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.86 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.8 p -72.07 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.058 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -100.5 -14.76 18.12 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.318 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.711 ' N ' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -130.75 -39.53 1.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.045 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -75.6 49.76 2.42 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.522 ' OH ' ' C ' ' A' ' 127' ' ' SER . 0.8 OUTLIER -118.57 -170.37 1.89 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.933 0.397 . . . . 0.0 110.638 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 82.5 p -60.08 146.52 42.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.139 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 40.7 p -126.94 -177.59 4.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.384 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.441 ' HG2' ' N ' ' A' ' 216' ' ' ALA . 80.8 tt0 65.22 159.14 0.11 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.182 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 216' ' ' ALA . . . . . 0.441 ' N ' ' HG2' ' A' ' 215' ' ' GLU . . . -56.94 138.83 53.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.682 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -77.35 -14.8 59.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.906 0.384 . . . . 0.0 110.54 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.573 ' O ' ' N ' ' A' ' 220' ' ' GLU . 82.2 m-85 -132.85 -105.3 0.25 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.9 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 219' ' ' GLU . 73.8 tt0 31.0 32.9 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.72 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 218' ' ' PHE . 12.4 mt-10 -61.33 139.86 94.66 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.521 -179.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.425 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 68.9 Cg_endo -76.88 14.63 1.25 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.582 2.188 . . . . 0.0 111.919 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -105.94 -62.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.319 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.494 HG13 ' H ' ' A' ' 224' ' ' ILE . 0.5 OUTLIER -61.11 -55.31 25.48 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 CA-C-O 121.073 0.464 . . . . 0.0 111.619 -179.326 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.494 ' H ' HG13 ' A' ' 223' ' ' VAL . 2.9 mm -62.75 -41.5 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 225' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 47.8 t0 -62.58 -37.7 87.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.95 0.405 . . . . 0.0 109.938 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 6.0 tp -60.19 -43.49 95.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.449 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 46.2 m0 -60.26 -38.63 84.11 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.054 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 228' ' ' ASP . . . . . 0.511 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 45.1 t0 -61.64 -33.83 74.63 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 178.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.647 ' O ' ' N ' ' A' ' 232' ' ' SER . 38.6 mt -64.32 -40.08 95.19 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.071 0.463 . . . . 0.0 110.695 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.521 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -24.58 -51.77 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.092 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.511 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 1.1 pt20 -58.27 -44.81 88.57 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.232 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.647 ' N ' ' O ' ' A' ' 229' ' ' LEU . 9.9 m -79.97 -7.54 58.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.377 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -81.91 10.73 5.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.928 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.6 m120 67.56 91.28 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.31 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 79.7 mt -129.73 166.34 20.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.701 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.0 p -73.46 161.56 30.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.722 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -63.99 -46.28 85.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.57 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -62.68 -46.71 86.92 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.993 0.425 . . . . 0.0 110.524 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -67.44 -37.96 83.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.557 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -63.07 -42.58 99.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.731 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -64.77 -52.83 54.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.522 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.59 -37.77 76.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.468 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -66.7 -44.14 82.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.853 178.789 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -57.3 -47.93 80.22 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.902 0.382 . . . . 0.0 110.264 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.96 -38.81 83.22 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.814 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -60.02 -49.6 77.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.944 0.402 . . . . 0.0 110.492 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.505 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 4.0 mm? -63.78 -40.33 96.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.976 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.5 -44.25 84.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.923 0.392 . . . . 0.0 110.037 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -67.01 -41.16 87.17 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.714 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -59.4 -48.89 79.9 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 120.739 0.304 . . . . 0.0 111.282 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 12.4 pt-20 -65.1 -37.65 88.17 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.76 -40.08 88.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.743 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -62.85 -45.39 92.78 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.428 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -65.05 -40.3 88.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.079 -0.649 . . . . 0.0 109.832 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.81 -44.56 96.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -61.82 -42.41 98.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.102 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 257' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -56.11 -45.49 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.24 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 258' ' ' ASN . . . . . 0.401 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 53.8 t-20 -59.13 -41.95 89.47 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.362 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -59.02 -45.52 90.5 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.371 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -62.18 -38.26 88.41 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.148 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -59.7 -42.28 92.64 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.049 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -62.07 -47.74 83.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.419 -0.513 . . . . 0.0 109.848 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -65.24 -34.09 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.111 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.43 -42.13 99.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.89 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -64.19 -47.6 79.13 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.05 -43.42 99.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.1 -38.17 82.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.975 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.82 -44.29 97.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.955 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 269' ' ' GLU . . . . . 0.543 ' OE2' ' NE2' ' A' ' 273' ' ' HIS . 17.3 tp10 -59.83 -44.84 93.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.136 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.09 -39.43 89.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 28.3 tp -60.3 -44.75 95.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.072 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 272' ' ' ARG . . . . . 0.425 ' NH2' ' OE1' ' A' ' 269' ' ' GLU . 86.6 mtm180 -61.15 -42.07 97.89 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.095 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 273' ' ' HIS . . . . . 0.543 ' NE2' ' OE2' ' A' ' 269' ' ' GLU . 18.1 m170 -67.85 -43.09 80.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.214 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.64 84.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.886 0.374 . . . . 0.0 110.939 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -64.3 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 7.8 t -61.95 -20.44 63.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.78 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.458 HG12 ' H ' ' A' ' 279' ' ' ASP . 91.5 t -61.3 -46.26 96.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.884 0.373 . . . . 0.0 110.413 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.72 58.04 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 279' ' ' ASP . . . . . 0.458 ' H ' HG12 ' A' ' 277' ' ' VAL . 91.1 m-20 -68.07 -24.06 65.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.602 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 83.78 5.74 87.73 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 281' ' ' GLU . . . . . 0.681 ' C ' ' H ' ' A' ' 283' ' ' VAL . 75.0 mm-40 -82.91 156.92 23.28 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 110.026 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 61.2 -17.8 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.732 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 283' ' ' VAL . . . . . 0.681 ' H ' ' C ' ' A' ' 281' ' ' GLU . 73.7 t -63.25 -47.4 92.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.66 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 5.9 t -64.3 -46.22 84.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.485 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -62.96 -46.25 88.62 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.927 0.394 . . . . 0.0 110.79 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 m -61.58 -42.09 98.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.529 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -64.32 -39.03 93.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.38 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -60.71 -55.3 34.84 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.751 ' HD3' HD23 ' A' ' 292' ' ' LEU . 8.1 mmtp -64.02 -32.8 74.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.375 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 290' ' ' HIS . . . . . 0.572 ' CE1' ' OE2' ' A' ' 294' ' ' GLU . 19.9 t-80 -57.82 -49.86 75.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.351 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.27 -39.12 82.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.746 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.751 HD23 ' HD3' ' A' ' 289' ' ' LYS . 4.4 tp -61.5 -47.13 87.02 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.341 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 1.1 mt -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.058 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.572 ' OE2' ' CE1' ' A' ' 290' ' ' HIS . 92.1 mt-10 -64.2 -36.14 83.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.12 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.92 89.42 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 296' ' ' ARG . . . . . 0.521 ' NH1' ' OE1' ' A' ' 299' ' ' GLU . 14.2 tpp180 -62.81 -42.7 99.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.682 0.277 . . . . 0.0 110.744 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 23.4 p -59.06 -50.04 75.61 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.427 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -63.07 -43.2 99.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.529 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 299' ' ' GLU . . . . . 0.521 ' OE1' ' NH1' ' A' ' 296' ' ' ARG . 83.6 tt0 -62.0 -40.54 96.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.294 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.61 95.64 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.267 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.65 -41.59 97.46 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 302' ' ' TYR . . . . . 0.469 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 70.1 t80 -62.15 -45.54 92.96 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.53 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 8.9 m -60.44 -43.4 96.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.447 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.97 -43.25 91.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 52.0 tttp -56.32 -50.41 71.55 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.342 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 306' ' ' LYS . . . . . 0.469 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 30.9 mtpt -62.78 -42.35 99.66 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.49 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -61.78 -37.97 86.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.449 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 9.4 mt -61.02 -44.61 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.277 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -68.96 -45.69 70.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.068 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -62.73 -52.07 64.68 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.536 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.04 -38.7 91.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.504 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.0 m -58.38 -44.61 88.99 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.381 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -73.06 -47.28 24.83 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.135 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -63.6 -45.44 90.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.743 0.306 . . . . 0.0 110.521 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.551 ' O ' ' C ' ' A' ' 316' ' ' SER . 2.5 mm -70.48 -27.02 29.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.576 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 316' ' ' SER . . . . . 0.551 ' C ' ' O ' ' A' ' 315' ' ' ILE . 23.1 t -37.15 -48.62 0.84 Allowed 'General case' 0 CA--C 1.486 -1.517 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.452 ' O ' ' N ' ' A' ' 319' ' ' ARG . 59.1 ttt85 -158.31 124.1 4.54 Favored 'General case' 0 N--CA 1.428 -1.557 0 C-N-CA 116.297 -2.161 . . . . 0.0 113.249 173.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.536 ' HA ' HD11 ' A' ' 323' ' ' LEU . . . -74.32 68.95 1.56 Allowed 'General case' 0 N--CA 1.403 -2.785 0 N-CA-C 102.873 -3.01 . . . . 0.0 102.873 175.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 317' ' ' ARG . 12.0 ptm180 -89.85 -37.46 14.43 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.78 -174.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 320' ' ' HIS . . . . . 0.636 ' O ' ' N ' ' A' ' 323' ' ' LEU . 0.3 OUTLIER -93.6 70.65 4.21 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.508 178.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 31.24 -102.69 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.861 -1.063 . . . . 0.0 112.859 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 25.4 mp0 -79.82 8.16 7.32 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 118.122 -1.431 . . . . 0.0 111.517 -178.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.636 ' N ' ' O ' ' A' ' 320' ' ' HIS . 14.8 mt . . . . . 0 C--O 1.221 -0.403 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.598 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.0 p -69.72 -14.51 62.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.69 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 55.49 80.97 0.12 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.505 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -134.46 21.39 3.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.627 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -71.91 139.53 48.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.68 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -162.79 75.19 0.41 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.53 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.479 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 1.5 mp0 -76.15 -54.94 1.9 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.822 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 7' ' ' GLN . 97.8 Cg_exo -37.75 134.73 0.57 Allowed 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.53 2.153 . . . . 0.0 111.893 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.713 ' H ' ' HD2' ' A' ' 10' ' ' PRO . 8.2 tttt -121.72 -47.93 0.04 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.977 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.713 ' HD2' ' H ' ' A' ' 9' ' ' LYS . 73.0 Cg_endo -83.07 101.66 1.02 Allowed 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.413 2.076 . . . . 0.0 112.325 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.469 ' O ' ' O ' ' A' ' 10' ' ' PRO . 3.1 m 57.92 146.01 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.62 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -69.29 149.61 70.11 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.447 2.098 . . . . 0.0 112.119 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -81.48 120.37 24.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.295 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -167.52 177.19 6.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.651 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -80.62 67.95 6.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.452 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 p -80.38 163.77 23.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.685 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 158.14 42.29 0.02 OUTLIER Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -162.01 123.08 2.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.722 0.296 . . . . 0.0 110.622 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.1 tp10 -131.28 -36.59 1.28 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.517 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.548 ' H ' ' CG ' ' A' ' 26' ' ' ASN . 33.5 m-85 -91.31 -178.72 5.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.19 -19.1 61.79 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.826 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.463 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 99.2 mmm -135.1 148.0 49.69 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.242 0.544 . . . . 0.0 110.916 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -64.36 -37.16 86.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.486 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.7 -48.59 80.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.117 0.484 . . . . 0.0 110.45 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.16 -38.32 86.03 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.496 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.548 ' CG ' ' H ' ' A' ' 20' ' ' PHE . 58.1 m-80 -63.27 -39.94 95.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.196 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -61.65 -43.9 97.98 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.282 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 2.3 mm? -62.6 -43.17 99.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.514 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 48.0 t-105 -63.01 -50.63 69.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.469 0.652 . . . . 0.0 110.346 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -56.91 -39.05 73.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.846 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -61.07 -44.37 97.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.024 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.82 88.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.806 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.514 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 76.1 mt-30 -61.14 -38.24 85.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.946 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 mmm-85 -64.12 -39.27 93.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.545 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 35' ' ' LEU . 88.8 mt -66.04 -32.54 74.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.397 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.422 ' ND1' ' O ' ' A' ' 33' ' ' GLN . 56.5 m-70 65.86 113.87 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.752 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.2 mt -138.38 154.49 73.68 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.753 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -42.01 154.6 0.1 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.454 2.102 . . . . 0.0 112.321 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -69.41 -40.35 5.99 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.548 2.165 . . . . 0.0 112.454 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 63.1 t -63.21 -48.92 85.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.578 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -66.31 -39.42 89.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.447 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.26 -41.84 99.08 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.552 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.44 78.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.52 -42.63 87.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.9 tp -62.45 -47.46 83.94 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.152 0.501 . . . . 0.0 110.748 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.6 t60 -61.03 -41.57 96.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.273 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.565 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.16 -48.37 81.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.727 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -54.11 -48.5 70.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.865 0.364 . . . . 0.0 110.251 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.82 -40.07 83.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -59.94 -40.01 87.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.565 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.3 mm -62.53 -42.9 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.81 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -59.67 -45.49 91.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.351 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -57.4 -48.0 80.22 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.346 0.593 . . . . 0.0 110.114 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -59.57 -43.97 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.311 0.577 . . . . 0.0 110.267 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -60.67 -40.16 91.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -58.29 -46.03 86.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.194 0.521 . . . . 0.0 109.848 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.87 -42.63 94.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.998 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.87 -45.2 95.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.549 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 82.2 t90 -56.09 -42.53 76.89 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.283 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.3 -45.95 91.58 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.205 0.526 . . . . 0.0 109.715 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -57.1 -44.63 83.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.11 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.3 mp -62.37 -40.11 95.36 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.021 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -56.46 -44.67 80.77 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 27.0 mt -62.15 -41.67 98.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.254 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -63.97 -36.13 82.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.074 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.4 69.7 1.05 Allowed Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.276 -0.729 . . . . 0.0 111.276 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 80.5 mt -127.09 -54.17 1.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.762 0.315 . . . . 0.0 110.842 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -71.48 126.69 30.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.489 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -124.76 -52.37 1.68 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.559 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -66.93 -32.86 74.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.483 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.49 18.14 53.13 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -59.69 -39.1 83.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 110.201 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -56.93 -64.26 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.079 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -48.0 -40.38 22.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.216 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.33 86.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.225 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.7 ttt85 -61.34 -41.1 96.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.442 ' N ' HD12 ' A' ' 77' ' ' LEU . 11.0 mp -61.89 -44.15 97.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.146 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.41 -45.77 92.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.293 0.568 . . . . 0.0 109.97 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 83' ' ' VAL . 40.7 mmm-85 -61.79 -38.9 89.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.962 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.4 ' O ' HG13 ' A' ' 84' ' ' ILE . 14.8 t-20 -64.02 -40.48 96.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.185 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.563 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -59.64 -49.86 76.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.311 0.577 . . . . 0.0 109.97 -179.392 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -66.17 -37.51 85.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.549 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.4 t -62.52 -46.57 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.653 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 80' ' ' ASN . 80.4 mt -61.35 -46.95 95.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.391 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 85' ' ' LEU . 29.6 mt -65.31 -39.35 92.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.911 0.386 . . . . 0.0 110.555 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.34 -48.21 82.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.866 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.405 ' HZ2' HG13 ' A' ' 83' ' ' VAL . 47.3 mttp -62.73 -45.33 93.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.776 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -64.35 -30.21 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.376 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.31 9.67 83.41 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 90' ' ' LEU . 95.8 mt -90.78 1.79 56.6 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.811 0.338 . . . . 0.0 110.349 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.425 ' CG ' ' N ' ' A' ' 92' ' ' GLY . 16.4 p-10 -61.37 -49.77 75.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.772 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.425 ' N ' ' CG ' ' A' ' 91' ' ' ASP . . . 158.85 -161.0 31.58 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.48 ' HG2' ' H ' ' A' ' 95' ' ' ASP . 82.9 tttt -140.17 144.94 36.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 0.0 110.409 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -132.29 37.75 3.52 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.582 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.48 ' H ' ' HG2' ' A' ' 93' ' ' LYS . 47.6 m-20 59.98 113.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.56 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -149.03 141.24 24.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.407 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.706 ' O ' ' N ' ' A' ' 99' ' ' VAL . 83.3 mtp180 -63.08 -45.2 93.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.666 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 55.19 -65.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.073 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.706 ' N ' ' O ' ' A' ' 97' ' ' ARG . 3.3 m -97.14 131.77 43.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.235 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.21 -7.2 22.36 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.484 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.592 ' O ' ' CG ' ' A' ' 102' ' ' ASN . 42.4 t -61.29 -41.75 97.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.494 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.639 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.8 OUTLIER 51.84 41.13 29.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.716 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.497 ' O ' ' O ' ' A' ' 104' ' ' LEU . 2.3 p -136.84 139.2 41.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.31 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.497 ' O ' ' O ' ' A' ' 103' ' ' SER . 4.1 mm? 55.78 152.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.319 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 88.3 p -62.88 -22.22 66.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.699 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.07 11.47 78.65 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.2 p -66.92 111.86 4.01 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -141.73 174.21 10.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.34 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 61.67 71.31 0.55 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.905 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -149.92 93.81 2.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.342 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.561 ' C ' HD22 ' A' ' 112' ' ' LEU . . . -125.39 -120.26 2.43 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.771 -0.931 . . . . 0.0 110.771 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.561 HD22 ' C ' ' A' ' 111' ' ' GLY . 4.4 mm? -109.6 128.46 55.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.051 0.453 . . . . 0.0 110.933 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -67.61 -42.7 81.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.423 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -79.77 132.89 59.79 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.639 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.8 -24.34 34.51 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.657 2.238 . . . . 0.0 112.141 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -64.21 -45.17 89.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.301 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.5 mt -68.38 -36.67 79.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.081 0.467 . . . . 0.0 110.439 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.409 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 98.0 mt-10 -55.89 -24.86 39.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.428 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.55 -49.87 74.93 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.78 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.928 HD22 ' CZ ' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -71.42 -46.68 59.5 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.146 0.498 . . . . 0.0 111.782 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.718 ' CE3' HD22 ' A' ' 135' ' ' LEU . 19.3 t-105 -55.89 -46.06 78.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.506 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.409 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.1 m80 -71.19 -34.07 70.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.539 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.577 ' O ' ' OG ' ' A' ' 127' ' ' SER . 10.3 tptt -55.54 -51.38 67.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.079 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -75.34 -47.15 29.05 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.974 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HB2' HD11 ' A' ' 135' ' ' LEU . 65.6 tttm -50.77 -39.55 52.69 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.747 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.3 m -94.1 -41.72 9.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.875 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.577 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 15.8 m -44.6 -27.11 0.44 Allowed 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.444 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -156.54 -97.08 0.13 Allowed Glycine 0 N--CA 1.462 0.373 0 C-N-CA 119.611 -1.281 . . . . 0.0 111.128 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.679 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.6 mttt -157.46 20.76 0.29 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.579 ' CE1' ' OE1' ' A' ' 134' ' ' GLU . 3.2 m-85 -60.12 50.05 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.671 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.679 ' N ' ' O ' ' A' ' 129' ' ' LYS . 0.1 OUTLIER -107.89 114.94 29.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.983 0.42 . . . . 0.0 111.705 -179.285 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.476 ' O ' ' HB3' ' A' ' 136' ' ' ASP . . . 120.51 -98.06 0.67 Allowed Glycine 0 CA--C 1.524 0.641 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.136 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.563 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 54.2 mp0 -78.79 -40.03 34.21 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.2 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.579 ' OE1' ' CE1' ' A' ' 130' ' ' PHE . 44.2 mt-10 -64.15 -43.55 94.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.563 0.697 . . . . 0.0 110.008 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.718 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -68.77 -35.62 77.29 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.275 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.517 ' CG ' ' N ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -62.36 -49.03 77.18 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.367 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 136' ' ' ASP . 18.6 ptpt -59.96 -38.52 82.73 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.478 ' N ' ' HG3' ' A' ' 137' ' ' LYS . 6.6 mt -59.84 -42.61 94.0 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.24 -39.19 78.64 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.583 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 81.9 mtp180 -54.45 -42.95 71.21 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.125 -1.03 . . . . 0.0 108.397 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -72.2 -39.4 68.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.728 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.928 ' CZ ' HD22 ' A' ' 120' ' ' LEU . 0.2 OUTLIER -59.76 -58.95 6.34 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.722 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.1 -41.01 97.76 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.583 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 36.4 m170 -57.62 -41.4 81.25 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.534 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.593 ' CE1' HG23 ' A' ' 197' ' ' ILE . 10.5 m-70 -64.33 -39.7 94.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.627 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -59.55 -47.64 84.75 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.488 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -68.43 -53.48 23.31 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.631 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.56 -40.93 96.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.997 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 145' ' ' HIS . 41.3 t -62.59 -44.17 99.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.173 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.689 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 0.8 OUTLIER -65.58 -38.96 91.02 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.576 -0.85 . . . . 0.0 109.312 -178.966 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.68 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 97.1 mt-10 -58.87 -45.94 88.98 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.125 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.499 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 2.5 m-85 -62.55 -43.6 98.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.654 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.99 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.049 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 150' ' ' HIS . 12.8 t -60.24 -46.4 94.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 18.3 mt -63.17 -45.58 91.17 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 0.0 110.643 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.439 ' N ' ' CD2' ' A' ' 156' ' ' LEU . 2.0 mm? -64.53 -41.52 96.32 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.439 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -67.58 -27.25 66.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.843 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 62.0 m -69.13 -46.71 66.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.723 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.456 ' C ' HD12 ' A' ' 159' ' ' LEU . 4.1 pp -79.12 -20.97 47.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.68 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.454 ' N ' HD12 ' A' ' 159' ' ' LEU . 66.4 m -66.69 -41.33 88.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.153 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -59.92 -46.93 87.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.127 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.661 ' C ' ' H ' ' A' ' 164' ' ' GLU . 1.7 t -79.28 -174.06 3.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.322 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.533 ' N ' ' OG1' ' A' ' 162' ' ' THR . 92.4 mt-10 65.89 -28.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.977 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.661 ' H ' ' C ' ' A' ' 162' ' ' THR . 77.2 tt0 -99.81 40.36 1.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.189 0.519 . . . . 0.0 109.7 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 8.9 tp -135.05 136.99 51.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.289 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -124.06 48.74 1.86 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -110.4 37.2 2.8 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.253 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -144.38 -85.97 0.13 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.583 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 79.7 t -142.19 135.77 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.877 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.443 HG23 ' O ' ' A' ' 170' ' ' ILE . 14.1 tt -121.73 125.61 73.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.586 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.37 165.13 18.17 Favored Pre-proline 0 C--N 1.331 -0.197 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.328 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.1 131.98 41.39 Favored 'Trans proline' 0 C--N 1.307 -1.617 0 C-N-CA 122.535 2.157 . . . . 0.0 111.964 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.769 ' OG ' ' N ' ' A' ' 177' ' ' ASP . 25.1 p -143.42 -20.13 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.501 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 25.5 t0 64.06 -28.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.614 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.66 ' H ' ' C ' ' A' ' 173' ' ' SER . 14.8 mt -100.87 28.41 5.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.479 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.468 ' C ' ' CG ' ' A' ' 177' ' ' ASP . 0.1 OUTLIER 61.44 35.23 17.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.497 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.769 ' N ' ' OG ' ' A' ' 173' ' ' SER . 0.4 OUTLIER 44.61 89.52 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.453 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.577 HD12 ' O ' ' A' ' 180' ' ' GLY . 10.7 pt -129.5 153.47 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.528 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -64.32 -41.8 96.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.605 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.577 ' O ' HD12 ' A' ' 178' ' ' ILE . . . -108.13 139.91 15.28 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 13.8 t -62.06 -45.85 91.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.867 0.365 . . . . 0.0 110.701 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.659 ' C ' ' H ' ' A' ' 184' ' ' HIS . 10.7 t -74.05 -83.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.657 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 59.2 tp 59.39 -36.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.06 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.659 ' H ' ' C ' ' A' ' 182' ' ' VAL . 3.2 p80 -56.76 -44.72 82.05 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.658 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.612 ' N ' ' CG ' ' A' ' 184' ' ' HIS . 11.8 t -65.68 -43.36 89.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.927 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.681 ' O ' HD13 ' A' ' 190' ' ' LEU . 65.2 ttt180 -61.89 -47.48 84.8 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.636 -178.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 187' ' ' HIS . . . . . 0.588 ' C ' ' ND1' ' A' ' 187' ' ' HIS . 0.3 OUTLIER -71.39 -31.0 66.79 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.283 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 188' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 184' ' ' HIS . 57.5 m -62.55 -45.08 94.56 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.093 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.76 -39.15 93.58 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.389 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.681 HD13 ' O ' ' A' ' 186' ' ' ARG . 4.6 mp -62.34 -41.89 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.033 0.444 . . . . 0.0 110.51 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -68.78 -33.78 74.46 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.846 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.609 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -67.8 -46.07 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.142 0.496 . . . . 0.0 111.685 -179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.413 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 pttt -72.03 -44.67 63.02 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.764 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.01 -41.3 97.51 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.558 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.609 ' HG3' ' O ' ' A' ' 192' ' ' GLU . 0.4 OUTLIER -66.04 -35.6 80.98 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.457 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 55.6 p -59.93 -39.68 86.33 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.593 HG23 ' CE1' ' A' ' 145' ' ' HIS . 70.2 mt -63.84 -43.59 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.26 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -62.25 -41.05 98.09 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.48 0.657 . . . . 0.0 109.303 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.421 ' HA ' ' OD2' ' A' ' 202' ' ' ASP . 25.4 mt-30 -61.95 -39.26 91.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.091 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.74 -39.63 95.54 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.72 -42.59 99.73 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.75 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 0.5 OUTLIER -63.1 -37.17 86.13 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.099 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.579 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 1.9 tmm_? -63.26 -41.75 99.08 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.325 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.83 -40.55 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.157 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.86 -43.68 98.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.511 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.682 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.1 mtt180 -63.7 -37.01 85.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.186 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.536 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 45.2 t -63.6 -45.33 97.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.093 0.473 . . . . 0.0 110.134 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -67.0 -29.38 69.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.63 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -94.32 -45.41 7.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.531 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 206' ' ' ARG . 46.1 tt0 -98.83 -31.4 11.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.141 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.536 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . -77.48 14.0 10.17 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.484 ' C ' ' CD1' ' A' ' 212' ' ' TYR . 2.1 t80 -60.41 -47.0 87.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.059 0.456 . . . . 0.0 110.535 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 26.6 t -175.58 45.94 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.76 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' ' 210' ' ' GLN . 37.4 p -138.93 161.06 38.25 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.655 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -138.36 145.76 41.48 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.543 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -166.36 120.98 1.14 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.193 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -175.33 37.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.234 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.653 ' CE2' ' NH2' ' A' ' 222' ' ' ARG . 79.3 m-85 -87.29 93.4 9.38 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 120.394 -0.523 . . . . 0.0 110.05 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -157.39 -43.34 0.07 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.178 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.87 158.24 54.53 Favored Pre-proline 0 N--CA 1.464 0.24 0 C-N-CA 120.776 -0.369 . . . . 0.0 110.556 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -54.65 128.38 30.06 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.391 2.061 . . . . 0.0 112.087 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.665 ' HE ' HG23 ' A' ' 223' ' ' VAL . 62.7 ttp180 179.05 -95.88 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.519 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.665 HG23 ' HE ' ' A' ' 222' ' ' ARG . 5.0 t -61.53 -51.38 73.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-O 121.548 0.69 . . . . 0.0 110.585 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.421 HG13 ' CZ3' ' A' ' 227' ' ' TRP . 1.7 mt -66.05 -28.41 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.749 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -63.79 -40.7 97.29 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.464 ' HA ' HD12 ' A' ' 229' ' ' LEU . 13.7 mt -62.31 -40.94 97.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.026 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.547 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 20.6 m0 -59.52 -38.6 81.39 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.095 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 228' ' ' ASP . . . . . 0.492 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 46.3 m-20 -63.5 -38.18 90.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.567 ' O ' ' N ' ' A' ' 232' ' ' SER . 89.1 mt -62.39 -41.55 98.74 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.129 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.481 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -32.75 -34.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.074 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.552 ' CG ' ' N ' ' A' ' 232' ' ' SER . 7.6 pt20 -66.26 -46.24 77.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.728 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.567 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.0 m -89.1 -6.75 56.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.362 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -72.99 9.54 1.15 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 234' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 232' ' ' SER . 58.8 t30 69.19 89.84 0.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.165 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.481 HD12 ' O ' ' A' ' 230' ' ' ALA . 79.6 mt -132.03 -173.25 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.687 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 62.1 p -84.38 164.77 18.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.6 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 237' ' ' ASP . . . . . 0.477 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 21.7 p-10 -73.81 -46.2 46.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.61 -46.58 89.21 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.171 0.51 . . . . 0.0 110.469 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 243' ' ' PHE . 82.7 tt0 -61.22 -35.82 78.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.707 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 231' ' ' GLN . 2.8 mt -64.56 -39.76 94.33 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.69 -52.55 62.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.25 95.33 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.583 -0.447 . . . . 0.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.489 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.2 OUTLIER -70.02 -32.88 71.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.304 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -62.56 -55.75 24.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.125 0.488 . . . . 0.0 110.31 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -65.51 -37.46 86.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.541 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -56.76 -50.21 72.95 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.218 0.532 . . . . 0.0 110.377 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.514 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.0 mm? -63.96 -39.54 94.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.741 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -54.76 -47.27 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.146 0.498 . . . . 0.0 110.475 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -67.32 -39.39 85.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.614 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -59.69 -49.77 76.46 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.018 0.437 . . . . 0.0 111.364 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.0 pt-20 -63.72 -37.34 86.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.932 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.86 88.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -61.42 -51.47 68.62 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.093 0.473 . . . . 0.0 111.006 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -66.31 -35.35 74.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.201 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.72 -44.54 95.94 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.324 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.2 -43.96 97.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.02 -44.36 82.79 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.093 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -60.91 -40.49 93.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.45 -48.59 81.08 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 110.444 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -62.81 -35.66 80.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -60.88 -44.48 97.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.183 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.98 -48.3 80.95 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.8 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -64.16 -34.1 77.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.866 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.25 -41.97 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.856 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.16 -45.5 84.68 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.554 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.2 mt -62.63 -43.4 98.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.118 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.36 88.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.209 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -60.92 -46.02 92.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.12 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.22 -45.99 91.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.136 0.493 . . . . 0.0 110.279 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.75 -40.14 94.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.447 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.722 HD23 ' O ' ' A' ' 271' ' ' LEU . 5.0 tt -59.17 -43.69 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.095 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -62.31 -41.08 98.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.269 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -66.81 -44.22 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.42 -36.92 85.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.627 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.03 -26.08 68.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 35.9 t -60.58 -39.83 89.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.376 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.42 -43.48 94.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.275 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.71 8.93 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -63.8 -42.88 97.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.732 0.301 . . . . 0.0 110.654 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 70.26 -3.85 9.96 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -96.98 -56.58 2.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 110.472 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -80.88 -15.95 54.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.746 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.51 -47.13 93.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.655 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 43.8 t -63.87 -43.99 94.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -59.73 -47.49 85.43 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.589 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 286' ' ' SER . . . . . 0.45 ' OG ' HD12 ' A' ' 271' ' ' LEU . 15.2 t -63.03 -45.87 90.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -63.96 -38.82 92.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.669 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.97 -57.85 11.26 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.155 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.644 ' HD3' HD23 ' A' ' 292' ' ' LEU . 24.3 mmtt -64.32 -35.58 81.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.12 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -51.41 -52.95 41.6 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.268 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.25 -36.16 79.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.663 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.644 HD23 ' HD3' ' A' ' 289' ' ' LYS . 10.9 tp -60.74 -52.03 66.83 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.374 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 293' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 293' ' ' LEU . 14.8 tp -62.74 -42.85 99.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.451 0.643 . . . . 0.0 109.923 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.626 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.6 tt0 -64.7 -33.24 75.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.876 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -65.08 -47.58 80.29 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 296' ' ' ARG . . . . . 0.526 ' HG3' ' N ' ' A' ' 297' ' ' THR . 0.0 OUTLIER -62.36 -36.98 83.93 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.626 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 16.1 p -61.51 -44.11 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.43 -43.72 98.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.215 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.66 -37.7 88.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.122 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 300' ' ' LEU . . . . . 0.517 ' O ' HD13 ' A' ' 300' ' ' LEU . 0.2 OUTLIER -62.64 -44.46 96.23 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.1 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.31 99.57 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -60.22 -44.56 95.08 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.144 0.497 . . . . 0.0 110.365 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.0 m -61.04 -42.76 99.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.381 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.1 -43.16 88.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.031 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -59.91 -49.75 76.47 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.203 0.525 . . . . 0.0 110.464 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -63.3 -42.42 99.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.55 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.496 ' O ' ' HB2' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.35 -37.5 87.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.898 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.447 ' O ' ' CB ' ' A' ' 312' ' ' SER . 12.2 mt -61.52 -42.45 98.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.489 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -65.78 -60.75 2.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.96 0.41 . . . . 0.0 111.374 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -60.63 -48.34 82.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.392 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 307' ' ' HIS . 9.1 tp -61.72 -40.73 96.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.563 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 312' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 11.4 t -59.2 -44.69 92.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.346 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.35 -38.02 95.75 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -63.15 -45.05 93.7 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.6 mm -71.84 -25.52 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.88 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 316' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' A' ' 317' ' ' ARG . 28.0 p -44.03 -61.31 1.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.668 ' HE ' ' CD2' ' A' ' 323' ' ' LEU . 7.3 ptt-85 -67.06 -38.86 86.56 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 317' ' ' ARG . . . 84.46 -34.7 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.42 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -149.63 140.14 22.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.954 0.883 . . . . 0.0 112.373 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -176.5 82.26 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 113.954 -1.476 . . . . 0.0 107.24 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 58.11 53.23 6.84 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.644 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 58.18 33.03 22.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.499 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.668 ' CD2' ' HE ' ' A' ' 317' ' ' ARG . 93.7 mt . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.582 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 86.3 t80 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 t -137.21 149.35 47.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.643 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 88.9 mmt-85 -113.7 100.82 8.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.529 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -143.46 112.23 6.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.517 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -78.44 -75.08 0.24 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.758 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 48.49 80.85 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.479 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.65 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -90.94 162.76 32.03 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.537 -179.738 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -64.73 149.17 90.12 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.568 2.179 . . . . 0.0 112.073 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 31.8 pttt -151.55 54.46 1.36 Allowed Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.078 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 9' ' ' LYS . 34.3 Cg_endo -67.15 153.91 76.02 Favored 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 122.641 2.227 . . . . 0.0 111.856 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.494 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -176.69 -56.24 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.846 -179.707 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 11' ' ' SER . 59.7 Cg_endo -69.65 150.89 69.45 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 122.393 2.062 . . . . 0.0 111.943 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -123.74 145.81 48.74 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.544 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.5 mtp180 -78.86 151.4 31.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.336 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -114.02 168.52 9.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.505 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -71.53 160.96 31.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.782 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -153.62 -38.73 0.02 OUTLIER Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -75.41 151.58 38.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.741 0.305 . . . . 0.0 110.568 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.9 -38.15 85.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.87 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -129.19 149.67 50.9 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.569 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -87.64 -12.2 46.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.512 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 78.5 mtp -119.42 138.5 53.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.109 0.48 . . . . 0.0 111.04 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -64.44 -36.53 84.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.44 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.94 -48.31 82.23 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.545 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.449 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.0 mp -61.73 -38.36 87.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.477 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 55.5 t-20 -63.18 -39.24 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.094 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.8 tp60 -60.25 -46.55 89.41 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.348 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.72 -42.47 98.99 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.352 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -61.59 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.176 0.512 . . . . 0.0 110.533 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -58.46 -44.03 89.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.128 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.21 -41.59 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.367 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.0 88.48 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.075 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -62.06 -39.61 92.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.853 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -61.7 -41.49 97.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.347 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.16 -39.63 95.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 65.91 107.96 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.821 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -125.08 154.6 71.52 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.678 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.412 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 82.8 Cg_exo -42.93 154.88 0.13 Allowed 'Trans proline' 0 N--CA 1.492 1.382 0 C-N-CA 122.507 2.138 . . . . 0.0 112.372 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 32.2 Cg_exo -56.01 -43.81 53.16 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.585 2.19 . . . . 0.0 112.209 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.472 ' H ' HG22 ' A' ' 40' ' ' VAL . 2.8 m -67.36 -46.06 84.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.996 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.6 mmt85 -65.37 -42.1 93.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.805 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 tp -63.92 -43.99 94.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.593 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.79 -42.76 90.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.675 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -66.96 -46.24 75.27 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.3 tp -62.94 -45.7 91.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.359 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -59.5 -41.96 91.09 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.983 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.51 -47.36 85.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.657 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -57.0 -47.21 81.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.365 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.4 mt -57.06 -41.99 79.73 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.224 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.63 -38.79 85.96 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.228 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 47' ' ' ALA . 4.9 mm -61.34 -43.32 96.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -58.16 -47.66 82.68 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.622 179.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.26 -47.4 81.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.154 0.502 . . . . 0.0 110.237 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.47 HH11 ' HD3' ' A' ' 54' ' ' ARG . 39.3 mtp-105 -62.0 -41.97 98.63 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.611 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -63.59 -36.81 85.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.413 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -60.66 -49.19 78.53 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.012 0.434 . . . . 0.0 109.999 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.83 -41.18 97.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.259 -0.577 . . . . 0.0 110.089 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.56 96.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.7 t90 -59.7 -42.59 93.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.729 0.299 . . . . 0.0 110.45 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -60.49 -45.61 93.12 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.771 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -60.72 -41.81 96.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.839 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.4 mt -61.05 -41.23 96.21 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.8 -38.91 86.97 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.684 ' O ' HD23 ' A' ' 64' ' ' LEU . 4.3 tt -60.34 -45.6 92.88 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -66.43 -34.65 78.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.32 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.83 30.03 8.25 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.6 mt -86.33 -49.6 7.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.732 0.301 . . . . 0.0 110.872 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.515 ' O ' ' OD1' ' A' ' 68' ' ' ASP . 49.2 p-10 -62.99 123.4 18.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.637 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -139.24 -35.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.436 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 71' ' ' GLY . 43.7 p-10 -66.21 -37.3 85.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.72 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.546 ' N ' ' OD1' ' A' ' 70' ' ' ASP . . . 88.04 0.51 83.11 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.44 -37.75 87.11 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.451 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.416 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 87.4 mttt -54.4 -53.91 47.75 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.003 0.43 . . . . 0.0 110.122 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -60.92 -39.13 88.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.93 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.59 -39.88 95.13 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.475 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.416 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 81.6 mtm180 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.527 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 83.8 mt -63.09 -44.97 94.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.211 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.7 -46.34 89.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-O 121.152 0.501 . . . . 0.0 110.375 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.581 ' O ' HG23 ' A' ' 83' ' ' VAL . 18.6 tpt180 -60.09 -43.8 95.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.977 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -61.73 -40.09 93.86 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.448 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.606 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.73 -48.73 80.5 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.717 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -65.17 -38.17 89.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.507 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 79' ' ' ARG . 55.2 t -62.93 -46.89 95.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.493 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.19 -51.07 77.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.467 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.72 -41.07 96.24 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.888 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.96 92.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.523 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -62.63 -47.76 82.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.992 0.425 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -72.78 -22.18 60.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.126 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.45 25.13 73.48 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 90' ' ' LEU . 38.7 mt -87.15 -2.48 58.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.886 0.374 . . . . 0.0 110.537 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -61.85 -45.12 95.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.707 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.51 158.01 20.11 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -146.6 154.2 41.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.834 0.349 . . . . 0.0 110.898 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -135.08 -165.49 1.68 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.68 179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.426 ' O ' ' N ' ' A' ' 97' ' ' ARG . 99.7 m-20 57.33 -85.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.717 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 94' ' ' LYS . . . 56.98 -85.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.952 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.426 ' N ' ' O ' ' A' ' 95' ' ' ASP . 21.7 mmm180 -93.87 -74.03 0.55 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.363 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 54.02 80.38 0.12 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.347 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.445 HG13 ' O ' ' A' ' 99' ' ' VAL . 14.5 p -127.09 131.18 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.749 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 81.2 p -138.72 154.13 48.55 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.675 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.2 t -179.14 120.0 0.07 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.509 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.599 ' CG ' ' H ' ' A' ' 103' ' ' SER . 12.8 p-10 -177.19 -85.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.947 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.599 ' H ' ' CG ' ' A' ' 102' ' ' ASN . 1.5 m 51.43 109.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.552 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.4 mp -96.24 -0.51 49.71 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.787 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 1.9 m 58.17 32.91 22.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.829 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -98.59 92.56 1.23 Allowed Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.957 -0.857 . . . . 0.0 110.957 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 11.6 t -149.1 163.46 37.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.712 0.291 . . . . 0.0 110.431 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -133.44 155.04 50.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.671 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 48.7 tp10 -153.23 136.04 15.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.499 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -151.82 116.59 5.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.767 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 172.39 -101.57 0.17 Allowed Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.489 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 73.8 mt -119.36 132.77 55.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.856 0.36 . . . . 0.0 110.647 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.468 ' OD1' ' O ' ' A' ' 113' ' ' ASP . 48.7 t0 -89.68 -26.59 20.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.452 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -82.69 114.9 55.25 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.691 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -54.44 -33.95 79.48 Favored 'Trans proline' 0 N--CA 1.498 1.775 0 C-N-CA 122.482 2.121 . . . . 0.0 112.517 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -60.51 -45.36 94.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.954 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.1 mt -68.83 -37.26 79.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.087 0.47 . . . . 0.0 110.375 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.489 ' OE2' ' O ' ' A' ' 112' ' ' LEU . 97.6 mt-10 -57.97 -25.96 61.69 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.599 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 70.1 mmtt -61.53 -54.75 39.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.703 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.61 -43.98 79.15 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.572 ' CE3' HD22 ' A' ' 135' ' ' LEU . 13.4 t-105 -58.84 -48.91 79.68 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.478 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.404 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.3 m80 -70.04 -33.38 71.9 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.733 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.534 ' O ' ' OG ' ' A' ' 127' ' ' SER . 11.6 tptt -56.86 -51.27 69.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.718 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.91 -47.28 59.97 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 119.596 -0.841 . . . . 0.0 111.086 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -53.71 -51.48 63.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.918 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.2 m -75.25 -43.27 52.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.73 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 9.6 m -44.48 -30.9 0.95 Allowed 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -160.54 -96.55 0.11 Allowed Glycine 0 CA--C 1.517 0.166 0 C-N-CA 119.48 -1.343 . . . . 0.0 111.526 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.693 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.6 mttt -153.63 21.43 0.53 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -59.14 50.56 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.511 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.693 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.8 p -109.17 135.4 50.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.348 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 96.43 -96.62 1.93 Allowed Glycine 0 CA--C 1.526 0.728 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.908 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.546 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 56.6 mp0 -72.71 -43.79 62.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.342 . . . . 0.0 111.166 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.514 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 46.9 mp0 -63.97 -51.77 62.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.023 0.439 . . . . 0.0 110.404 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.572 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.8 mt -61.56 -39.69 92.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.673 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -60.32 -42.81 96.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.975 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -62.04 -41.4 98.07 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 110.094 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.51 HD13 ' O ' ' A' ' 134' ' ' GLU . 9.4 mp -59.81 -41.81 92.07 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.415 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -66.54 -35.44 80.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 176.687 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -55.31 -43.27 74.7 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.233 178.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.736 ' OE1' HD21 ' A' ' 204' ' ' LEU . 96.5 mt-10 -71.18 -41.19 70.65 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.824 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.415 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 3.6 m-85 -60.46 -54.93 39.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.793 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.02 -39.59 90.33 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.937 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -56.16 -42.68 77.41 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.578 ' CE1' HG23 ' A' ' 197' ' ' ILE . 5.7 m-70 -63.05 -40.78 98.73 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.425 178.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -61.49 -42.93 99.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.884 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.593 ' HA ' ' CE1' ' A' ' 150' ' ' HIS . 98.7 mt-10 -67.97 -46.25 71.9 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 111.555 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -70.83 -43.93 67.55 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.55 -50.62 77.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.725 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -70.08 -23.87 63.14 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.59 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.651 ' HG2' ' CE1' ' A' ' 150' ' ' HIS . 19.8 mm-40 -68.18 -45.0 74.64 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.404 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 16.8 m-85 -62.78 -45.35 93.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -65.5 -41.03 93.66 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.583 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 150' ' ' HIS . 35.2 t -61.94 -46.33 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.0 0.429 . . . . 0.0 110.286 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 81.2 mt -63.44 -43.1 98.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.513 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.582 HD21 HD21 ' A' ' 190' ' ' LEU . 35.0 mt -63.19 -44.29 95.78 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.773 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -67.06 -29.88 69.79 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.972 0.415 . . . . 0.0 110.411 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 58.7 m -71.79 -47.22 54.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.297 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.694 HD12 ' N ' ' A' ' 160' ' ' SER . 4.4 pp -79.11 -29.48 43.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.813 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.694 ' N ' HD12 ' A' ' 159' ' ' LEU . 85.6 p -62.19 -41.79 98.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.619 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -74.03 -49.12 25.68 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.696 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.63 ' C ' ' H ' ' A' ' 164' ' ' GLU . 0.2 OUTLIER -97.78 176.14 5.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.398 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.447 ' H ' HG22 ' A' ' 162' ' ' THR . 50.1 mt-10 53.66 1.31 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.085 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.63 ' H ' ' C ' ' A' ' 162' ' ' THR . 68.9 tt0 -131.51 44.84 2.88 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.404 ' O ' HG23 ' A' ' 165' ' ' ILE . 16.5 tt -134.68 133.26 54.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.843 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -172.12 40.24 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.477 ' HG2' ' N ' ' A' ' 168' ' ' ASN . 78.0 tt0 60.43 163.1 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.493 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.477 ' N ' ' HG2' ' A' ' 167' ' ' GLU . 58.6 t30 -69.69 108.24 3.8 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.924 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 169' ' ' VAL . 5.4 p -155.03 124.26 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.355 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 17.3 tt -135.3 147.47 29.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.609 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.21 165.58 12.45 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 120.779 0.323 . . . . 0.0 110.415 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.83 -30.91 49.4 Favored 'Trans proline' 0 C--N 1.308 -1.603 0 C-N-CA 122.645 2.23 . . . . 0.0 112.005 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 11.4 m -51.56 114.81 1.36 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.841 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -64.73 -38.16 90.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.168 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -137.8 42.89 2.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.243 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.53 ' O ' ' OG ' ' A' ' 176' ' ' SER . 0.3 OUTLIER 54.04 19.22 1.97 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.307 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 45.27 65.71 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.208 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.685 HG22 ' H ' ' A' ' 180' ' ' GLY . 25.0 mt -106.2 127.95 61.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.373 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -86.26 -8.74 57.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.48 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.685 ' H ' HG22 ' A' ' 178' ' ' ILE . . . 133.03 48.8 0.1 OUTLIER Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.509 ' H ' ' CG2' ' A' ' 178' ' ' ILE . 61.7 m -63.48 -85.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.622 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 6.3 t -147.35 -8.94 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.875 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 57.7 tp -62.48 -44.22 96.91 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.225 0.536 . . . . 0.0 110.735 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.424 ' CG ' ' N ' ' A' ' 185' ' ' SER . 9.9 p-80 -56.92 -42.01 79.19 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.538 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.424 ' N ' ' CG ' ' A' ' 184' ' ' HIS . 71.6 m -60.33 -42.71 96.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.196 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -61.37 -41.65 97.43 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.545 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 187' ' ' HIS . . . . . 0.4 ' HA ' HD12 ' A' ' 190' ' ' LEU . 50.5 m-70 -64.9 -41.01 95.96 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.391 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 60.7 m -61.26 -44.45 97.23 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.307 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.76 -38.58 88.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.29 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.582 HD21 HD21 ' A' ' 156' ' ' LEU . 11.4 mt -60.93 -46.86 88.98 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.539 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.555 ' HB3' HH21 ' A' ' 195' ' ' ARG . 56.5 mtpt -74.36 -32.52 62.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 11.2 tm-20 -68.08 -44.81 75.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.364 . . . . 0.0 111.296 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.502 ' NZ ' HD23 ' A' ' 190' ' ' LEU . 17.4 pttt -73.47 -43.91 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.173 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.724 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.83 -40.83 88.12 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.854 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.555 HH21 ' HB3' ' A' ' 191' ' ' LYS . 17.9 ptp180 -67.36 -38.19 84.39 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.447 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.3 p -60.31 -41.15 92.88 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.578 HG23 ' CE1' ' A' ' 145' ' ' HIS . 92.1 mt -64.3 -44.63 97.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.452 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.75 -40.85 98.53 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.961 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.403 ' HA ' ' OD2' ' A' ' 202' ' ' ASP . 89.4 mm-40 -60.4 -41.3 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.688 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.92 -40.15 98.48 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 201' ' ' LEU . 36.2 mt -62.04 -42.86 99.63 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.109 179.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.538 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.4 OUTLIER -64.14 -35.27 80.23 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.474 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.3 tmt_? -60.98 -43.77 98.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.739 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.736 HD21 ' OE1' ' A' ' 141' ' ' GLU . 31.6 mt -62.26 -40.25 95.58 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -64.99 -45.08 87.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.991 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' A' ' 210' ' ' GLN . 82.7 mtp180 -65.21 -44.43 88.36 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.146 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.459 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -68.31 -40.87 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.131 0.491 . . . . 0.0 110.345 -179.459 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.444 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 68.4 m -60.28 -37.91 81.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.473 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -95.42 -46.66 6.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.636 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 206' ' ' ARG . 54.9 tt0 -81.3 -35.65 30.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.109 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -90.79 58.95 3.28 Favored Glycine 0 CA--C 1.519 0.297 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.607 ' CD2' ' O ' ' A' ' 213' ' ' SER . 67.2 t80 -120.08 164.51 16.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.922 0.391 . . . . 0.0 110.532 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.607 ' O ' ' CD2' ' A' ' 212' ' ' TYR . 26.9 p -77.26 163.53 26.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.968 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 1.4 t -150.43 156.37 41.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.786 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -149.77 -178.0 6.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.282 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -142.08 -175.01 4.26 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.101 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.544 ' O ' ' HB3' ' A' ' 218' ' ' PHE . 26.1 tp10 -138.56 6.67 2.52 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.357 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.671 ' CG ' ' N ' ' A' ' 219' ' ' GLU . 68.3 t80 82.32 178.72 0.07 Allowed 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.84 ' O ' HG11 ' A' ' 223' ' ' VAL . 2.7 tm-20 74.55 52.31 0.09 Allowed 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 -176.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.507 ' O ' ' CG1' ' A' ' 223' ' ' VAL . 4.2 mp0 61.56 148.19 0.09 OUTLIER Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.226 -177.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.475 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 74.3 Cg_endo -79.3 169.99 18.11 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.396 2.064 . . . . 0.0 111.759 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 89.6 mtm180 69.59 -46.77 0.59 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.517 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 1.018 HG13 ' H ' ' A' ' 224' ' ' ILE . 3.4 p -57.64 -97.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.798 0 CA-C-O 121.458 0.647 . . . . 0.0 111.831 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 1.018 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.3 OUTLIER -42.92 -29.07 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.333 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 225' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 223' ' ' VAL . 98.5 m-20 -62.51 -44.84 95.37 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 223' ' ' VAL . 1.5 mp -59.99 -40.18 88.28 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.557 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 33.3 m0 -59.68 -43.0 94.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.783 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -67.75 -27.26 66.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 2.0 mt -63.08 -46.27 88.18 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.411 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.537 ' O ' ' C ' ' A' ' 231' ' ' GLN . . . -35.54 -67.25 0.16 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.814 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.537 ' C ' ' O ' ' A' ' 230' ' ' ALA . 12.8 tt0 24.62 -103.73 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.937 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.0 p -113.47 27.84 9.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.331 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.86 81.85 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.327 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -175.34 72.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.682 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.573 HD22 ' HD3' ' A' ' 319' ' ' ARG . 96.3 mt -134.61 -169.25 2.3 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.741 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.414 ' OG1' ' OE1' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -110.46 -152.56 0.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.764 -178.902 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -92.53 -59.54 2.05 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.117 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.08 -42.8 99.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.414 ' OE1' ' OG1' ' A' ' 236' ' ' THR . 89.2 mt-10 -60.18 -34.0 72.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.602 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.681 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -62.75 -44.4 96.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.292 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -64.89 -47.73 76.74 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.665 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.25 99.2 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.785 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.511 ' O ' ' HG2' ' A' ' 246' ' ' GLU . 1.3 t80 -61.82 -47.58 84.47 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.007 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.25 -42.53 98.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.572 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -59.09 -57.88 11.1 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.396 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 246' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 243' ' ' PHE . 13.3 pt-20 -58.99 -38.87 80.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.948 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 1.9 mm? -61.55 -41.98 98.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.381 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.408 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 65.9 tttm -61.09 -42.23 98.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.157 0.503 . . . . 0.0 109.858 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -65.91 -39.5 90.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.801 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -61.84 -48.49 80.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.562 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 13.7 pt-20 -62.01 -41.87 98.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.079 0.466 . . . . 0.0 110.114 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 252' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -62.83 -38.2 89.82 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.152 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -61.96 -62.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.247 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.13 -37.21 13.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.03 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -65.35 -46.35 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.688 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -62.98 -43.31 99.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -58.07 -43.87 87.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.863 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.11 -40.65 94.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.252 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 259' ' ' HIS . . . . . 0.422 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 83.1 t60 -59.18 -47.61 84.67 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.297 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -62.7 -37.43 86.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.363 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 261' ' ' GLN . . . . . 0.418 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 32.3 mm-40 -57.77 -47.66 81.88 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 120.993 0.425 . . . . 0.0 110.4 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -61.76 -43.24 99.25 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.042 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 263' ' ' GLN . . . . . 0.422 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 4.6 mp0 -60.46 -39.02 86.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.902 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 264' ' ' LEU . . . . . 0.403 HD21 ' HB3' ' A' ' 293' ' ' LEU . 38.0 mt -61.98 -41.84 98.48 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.338 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.92 -48.02 83.75 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-O 121.118 0.485 . . . . 0.0 110.44 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.3 mt -63.03 -43.49 99.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.157 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.12 85.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.27 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.53 -47.73 84.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.222 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -63.31 -45.0 93.37 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.992 0.425 . . . . 0.0 110.676 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -61.33 -42.88 99.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.469 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.668 HD23 ' O ' ' A' ' 271' ' ' LEU . 1.8 tt -60.8 -42.66 98.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.907 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -59.69 -44.07 93.78 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.257 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -71.59 -34.05 69.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.88 0.371 . . . . 0.0 110.509 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.581 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.84 -37.24 86.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.07 -25.36 66.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.871 0.367 . . . . 0.0 110.537 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 67.4 m -87.95 2.72 50.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.874 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.583 HG13 ' N ' ' A' ' 278' ' ' GLY . 11.0 p -60.47 -44.47 96.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.652 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.583 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 156.9 -99.26 0.18 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -61.97 -40.93 97.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 0.0 110.258 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.5 32.81 40.9 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -66.68 -36.8 83.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.836 0.351 . . . . 0.0 110.738 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -77.49 -6.75 54.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.99 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.99 -44.99 99.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.8 t -60.5 -45.32 94.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.149 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.96 -45.84 93.14 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.992 0.425 . . . . 0.0 110.756 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 50.5 m -60.63 -41.9 95.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.182 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -62.23 -40.6 96.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.587 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.02 -57.02 14.93 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.671 ' HD3' HD23 ' A' ' 292' ' ' LEU . 15.0 mmtm -64.62 -35.93 82.6 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.304 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -52.68 -46.99 67.47 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.47 -37.66 80.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.47 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.671 HD23 ' HD3' ' A' ' 289' ' ' LYS . 19.6 tp -61.25 -51.12 70.25 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.712 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 293' ' ' LEU . . . . . 0.403 ' HB3' HD21 ' A' ' 264' ' ' LEU . 10.2 mp -63.56 -41.29 98.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.044 0.45 . . . . 0.0 109.979 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -65.34 -35.04 79.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.077 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.5 -50.07 67.92 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -62.17 -42.74 99.55 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.611 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.418 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 9.4 m -61.28 -48.71 80.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.472 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.33 -41.93 98.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.171 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -62.28 -40.23 95.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.1 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -43.63 98.32 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.128 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.68 98.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.72 -44.61 96.58 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.043 0.449 . . . . 0.0 110.513 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.4 m -60.28 -44.44 95.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.449 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.09 -42.54 90.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.926 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.56 -51.38 70.15 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 110.809 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.67 -43.41 96.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.24 -36.41 83.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.993 0.425 . . . . 0.0 109.981 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.557 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 12.2 mt -60.35 -44.55 95.45 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.138 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 309' ' ' GLN . . . . . 0.403 ' O ' ' OG ' ' A' ' 312' ' ' SER . 96.5 mm-40 -70.91 -57.3 4.72 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.543 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.86 -49.9 75.62 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.676 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 12.9 tp -62.59 -41.63 99.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.508 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 312' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 37.5 p -59.47 -40.59 87.43 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.439 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.93 -41.06 95.6 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.553 ' HE ' ' HG ' ' A' ' 323' ' ' LEU . 79.0 mtp180 -61.74 -44.62 96.55 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.724 -0.28 . . . . 0.0 110.86 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.569 ' C ' ' H ' ' A' ' 318' ' ' ALA . 2.7 mm -65.01 -41.99 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.0 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.6 t -47.65 -42.67 24.99 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -97.2 5.58 49.87 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.569 ' H ' ' C ' ' A' ' 315' ' ' ILE . . . 56.63 -89.98 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.744 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.625 ' CB ' HD13 ' A' ' 323' ' ' LEU . 4.2 ptm180 168.57 113.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.333 -178.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -65.8 -44.03 86.9 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.49 ' O ' ' O ' ' A' ' 322' ' ' GLU . 2.4 p30 -147.47 80.26 1.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.664 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.49 ' O ' ' O ' ' A' ' 321' ' ' ASN . 80.7 tt0 43.42 102.63 0.0 OUTLIER 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.993 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.625 HD13 ' CB ' ' A' ' 319' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.548 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.423 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 64.9 t80 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.7 m -62.38 -40.98 98.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.732 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.9 ttt85 -133.56 141.7 47.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.506 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -126.33 138.55 53.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.735 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -152.24 133.21 14.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.451 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -105.9 144.56 32.45 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.664 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.658 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -117.08 -50.47 0.04 OUTLIER Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.163 -179.777 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.658 ' HD2' ' H ' ' A' ' 7' ' ' GLN . 94.4 Cg_endo -82.79 160.31 16.26 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.577 2.184 . . . . 0.0 112.223 -179.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.68 157.82 48.93 Favored Pre-proline 0 N--CA 1.464 0.255 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.197 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.98 155.96 56.76 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.637 2.225 . . . . 0.0 112.086 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.632 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -103.56 -39.07 0.2 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.739 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.632 ' CD ' ' N ' ' A' ' 11' ' ' SER . 31.6 Cg_exo -59.75 146.02 96.64 Favored 'Trans proline' 0 N--CA 1.494 1.549 0 C-N-CA 122.571 2.181 . . . . 0.0 111.813 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -68.11 107.48 2.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.516 -179.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.428 ' HG2' ' O ' ' A' ' 14' ' ' ARG . 67.1 ttt-85 -112.31 26.73 10.29 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.143 0.497 . . . . 0.0 110.341 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.459 ' HG2' ' N ' ' A' ' 16' ' ' SER . 84.9 tt0 50.08 -108.18 0.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.587 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.459 ' N ' ' HG2' ' A' ' 15' ' ' GLU . 16.4 t 41.82 -139.53 0.14 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.943 0.402 . . . . 0.0 110.644 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.79 151.25 26.7 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.706 -0.957 . . . . 0.0 110.706 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -131.03 132.65 45.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.896 0.379 . . . . 0.0 110.668 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 57.5 mp0 -140.18 -1.38 1.55 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.432 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -140.62 161.12 38.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.912 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -62.85 -34.8 78.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.06 147.51 46.01 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.744 0.783 . . . . 0.0 111.222 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -63.57 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.557 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -55.57 -48.61 74.51 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.388 0.613 . . . . 0.0 109.954 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.74 -38.78 91.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.327 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -62.63 -39.03 92.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.573 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.78 -47.28 87.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.511 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.425 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.8 mm? -60.64 -41.85 95.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.048 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.491 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 49.5 t-105 -60.03 -45.23 93.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.282 0.563 . . . . 0.0 110.435 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -56.9 -43.76 81.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.153 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -60.62 -41.72 95.39 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.338 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.95 86.78 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.076 0.465 . . . . 0.0 110.046 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.491 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 76.5 mt-30 -62.6 -37.86 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -60.6 -43.9 96.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.401 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.12 -38.89 92.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.57 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.87 105.66 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.756 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -127.53 154.39 77.51 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.631 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -38.57 155.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.791 2.327 . . . . 0.0 112.144 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.37 -43.25 18.67 Favored 'Trans proline' 0 C--N 1.307 -1.639 0 C-N-CA 122.675 2.25 . . . . 0.0 112.403 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 76.9 t -63.66 -47.16 92.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.472 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -64.08 -41.75 97.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.3 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.68 HD23 ' C ' ' A' ' 42' ' ' LEU . 8.5 tt -61.93 -43.47 98.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.33 -41.54 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.234 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.51 -44.66 74.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.1 tp -62.73 -49.2 75.98 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.961 0.41 . . . . 0.0 110.462 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -59.81 -42.06 92.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.47 -38.93 93.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.606 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -60.34 -52.42 65.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.096 0.474 . . . . 0.0 110.455 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.01 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.253 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.09 -45.73 83.14 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.286 0.565 . . . . 0.0 110.187 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.38 -42.78 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.661 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 tp60 -52.97 -41.83 64.95 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -63.43 -40.74 97.98 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -61.51 -43.58 98.61 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.467 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -60.54 -42.23 96.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.539 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.56 -47.59 79.14 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.323 0.583 . . . . 0.0 109.889 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.54 -39.74 88.99 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.34 0.59 . . . . 0.0 109.811 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.72 87.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.612 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 68.7 t90 -57.21 -39.92 76.42 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -58.42 -46.69 85.98 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.24 -43.52 96.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.308 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -62.19 -40.41 95.97 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.015 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -58.5 -43.62 89.14 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.1 mt -60.96 -40.47 93.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.775 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 57.3 t0 -64.84 -35.49 81.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.26 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.1 33.33 7.35 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.181 -0.767 . . . . 0.0 111.181 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.2 mt -91.86 -40.37 11.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.913 0.387 . . . . 0.0 110.738 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -88.11 117.0 26.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.549 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -125.74 -37.82 2.28 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.515 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -67.09 -34.0 76.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.735 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.27 12.61 62.99 Favored Glycine 0 CA--C 1.528 0.849 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.55 -37.62 88.03 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.439 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -60.42 -47.11 87.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.067 0.461 . . . . 0.0 110.251 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -59.81 -43.5 94.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.363 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.69 -37.95 86.01 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.522 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.05 -41.69 99.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.89 -43.73 95.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.29 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.22 -44.5 97.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.076 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.616 ' O ' HG23 ' A' ' 83' ' ' VAL . 44.9 ttm180 -59.09 -42.45 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.063 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -62.72 -40.46 97.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.556 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.671 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.41 -48.45 80.61 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.89 -179.574 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -64.9 -38.88 92.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.659 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 79' ' ' ARG . 61.4 t -62.52 -46.4 96.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 94.1 mt -60.49 -48.2 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.066 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' A' ' 85' ' ' LEU . 22.7 mt -65.01 -40.86 95.54 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.068 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.37 -47.35 85.76 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.805 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.14 -47.58 82.14 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.116 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -66.15 -27.22 67.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.448 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 68.27 24.98 74.83 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 90' ' ' LEU . 97.2 mt -103.45 16.06 27.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.831 0.348 . . . . 0.0 110.827 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.559 ' OD1' ' N ' ' A' ' 92' ' ' GLY . 41.6 p-10 -60.95 -40.93 95.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.606 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.559 ' N ' ' OD1' ' A' ' 91' ' ' ASP . . . 114.88 51.95 0.44 Allowed Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 53.8 tttm -144.99 92.55 2.28 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.778 0.323 . . . . 0.0 110.295 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -92.96 -23.82 18.59 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.651 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 58.84 49.54 9.74 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.815 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.675 ' O ' ' N ' ' A' ' 98' ' ' GLN . . . 64.99 -85.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.46 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 44.17 -80.66 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.606 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.675 ' N ' ' O ' ' A' ' 96' ' ' ALA . 17.2 tt0 54.25 82.04 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.798 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 5.3 m -127.78 129.9 70.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.272 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 54.1 m -111.57 114.07 26.9 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.64 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.7 t -63.59 -45.59 89.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.731 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -97.27 76.71 2.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.397 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.2 p -72.66 151.62 42.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.714 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 37.3 tp -122.27 128.58 51.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.082 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 42.3 t -131.16 150.16 52.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.498 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -130.69 38.19 1.99 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.427 ' H ' HG22 ' A' ' 107' ' ' THR . 0.0 OUTLIER -62.43 -44.12 97.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.792 0.329 . . . . 0.0 110.331 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.413 ' O ' ' O ' ' A' ' 107' ' ' THR . 99.0 mm-40 49.95 99.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.721 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -138.51 -22.94 0.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.553 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -62.84 -42.34 99.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.624 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.508 ' C ' HD22 ' A' ' 112' ' ' LEU . . . 110.87 -55.09 0.52 Allowed Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.933 ' N ' HD22 ' A' ' 112' ' ' LEU . 0.9 OUTLIER -107.85 129.16 55.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.978 0.418 . . . . 0.0 110.447 -179.471 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -85.72 -65.03 1.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.862 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -93.71 152.35 40.68 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.47 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.47 -18.69 43.56 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.707 2.271 . . . . 0.0 111.909 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -63.82 -43.7 95.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.844 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.581 ' N ' HD12 ' A' ' 117' ' ' LEU . 7.2 mp -74.33 -28.07 60.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.612 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.421 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 98.5 mt-10 -60.45 -32.65 71.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.642 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.4 mtmt -62.09 -45.91 91.43 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.905 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 47.6 mt -69.02 -46.59 67.58 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.552 ' CE3' HD22 ' A' ' 135' ' ' LEU . 8.4 t-105 -62.95 -44.47 95.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.542 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.421 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.5 m80 -69.47 -38.94 77.95 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.164 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.521 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.0 mptt -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.173 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.464 ' HB1' ' HB2' ' A' ' 130' ' ' PHE . . . -70.26 -45.57 66.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.791 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.482 ' HB2' HD11 ' A' ' 135' ' ' LEU . 65.3 tttm -48.25 -46.08 35.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.136 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 18.2 m -109.65 -60.2 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.643 -0.423 . . . . 0.0 112.005 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.64 -11.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.748 -178.824 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.432 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -134.13 -3.74 3.09 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 56.91 12.75 1.27 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.265 0.555 . . . . 0.0 109.756 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.464 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 6.0 m-30 -68.86 50.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.669 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 5.6 p -96.15 118.15 32.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.731 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 119.93 -97.97 0.69 Allowed Glycine 0 CA--C 1.53 0.979 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.492 178.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -78.85 -43.57 24.81 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.268 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.487 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.0 mp0 -60.67 -47.39 86.48 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.555 -0.458 . . . . 0.0 109.851 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.552 HD22 ' CE3' ' A' ' 121' ' ' TRP . 2.0 mt -62.87 -41.62 99.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.018 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.39 -40.57 94.83 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.999 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.6 -42.27 99.47 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.077 0.465 . . . . 0.0 110.173 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.59 -43.97 93.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.444 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -67.06 -37.7 84.48 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -53.32 -43.93 68.01 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.721 ' OE1' HD21 ' A' ' 204' ' ' LEU . 97.8 mt-10 -71.5 -40.85 69.92 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.669 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.444 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.9 m-85 -59.01 -57.91 10.99 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.568 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 44.3 mt -60.72 -39.06 87.22 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.299 -0.561 . . . . 0.0 110.254 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -51.32 -48.05 62.49 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -63.27 -39.86 95.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.664 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt -61.04 -41.56 96.81 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.318 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -67.68 -53.11 30.36 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 120.77 0.319 . . . . 0.0 111.577 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -61.3 -44.04 97.87 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.808 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.4 t -62.08 -43.86 98.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.747 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.682 ' O ' ' OD1' ' A' ' 153' ' ' ASN . 2.3 m170 -60.14 -41.59 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.56 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -64.79 -37.82 88.9 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.514 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -68.39 -50.67 51.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.131 0.491 . . . . 0.0 111.141 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ASN . . . . . 0.804 ' OD1' ' N ' ' A' ' 154' ' ' VAL . 56.5 p30 -72.45 -38.43 68.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.865 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.804 ' N ' ' OD1' ' A' ' 153' ' ' ASN . 40.1 t -61.02 -46.45 96.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 155' ' ' LEU . 71.4 mt -64.21 -43.19 95.79 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.401 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.451 ' O ' ' OG ' ' A' ' 160' ' ' SER . 20.1 mt -62.37 -43.86 97.83 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.609 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.3 -31.54 71.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.105 0.479 . . . . 0.0 110.185 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 66.6 m -63.75 -50.89 67.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.884 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.404 HD12 ' N ' ' A' ' 160' ' ' SER . 1.7 pp -77.11 -31.06 55.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.663 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.451 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 74.4 m -60.3 -42.15 94.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.686 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.405 ' C ' ' H ' ' A' ' 163' ' ' GLU . 97.8 mtt180 -61.97 -44.26 97.11 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.947 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.642 HG22 ' O ' ' A' ' 162' ' ' THR . 35.6 m -77.91 36.36 0.22 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.754 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 161' ' ' ARG . 80.8 tt0 -141.07 -31.24 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.943 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.454 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 69.1 tt0 -102.7 24.39 10.62 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.398 0.618 . . . . 0.0 109.935 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.684 ' O ' HG23 ' A' ' 165' ' ' ILE . 8.2 tp -56.0 104.95 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.731 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 54.2 m170 45.98 30.51 0.92 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.13 0.49 . . . . 0.0 110.111 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -81.86 89.0 6.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.479 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -101.49 14.14 32.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.285 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 11.8 t -93.58 133.37 34.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.62 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 17.9 tt -119.13 137.97 51.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.458 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' SER . . . . . 0.516 ' O ' ' N ' ' A' ' 173' ' ' SER . 6.9 t -136.5 85.9 24.65 Favored Pre-proline 0 C--O 1.232 0.154 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.504 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -38.88 87.38 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.456 0 C-N-CA 122.692 2.262 . . . . 0.0 112.038 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.516 ' N ' ' O ' ' A' ' 171' ' ' SER . 8.0 t -114.48 133.96 55.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.473 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -58.78 -10.12 2.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.974 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.538 ' O ' ' CG1' ' A' ' 178' ' ' ILE . 0.5 OUTLIER -169.47 52.94 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.732 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.639 ' O ' ' N ' ' A' ' 178' ' ' ILE . 2.7 m 59.44 144.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.834 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -60.39 64.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.567 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.639 ' N ' ' O ' ' A' ' 176' ' ' SER . 3.7 pt -128.32 147.17 32.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.8 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -63.97 -41.4 97.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.311 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 88.13 89.12 1.12 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.539 ' C ' ' NE2' ' A' ' 184' ' ' HIS . 24.7 m -166.74 0.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.658 0.266 . . . . 0.0 110.735 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 9.2 t -146.3 -24.52 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.713 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 183' ' ' LEU . 4.2 mm? -63.42 -40.02 96.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.976 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.539 ' NE2' ' C ' ' A' ' 181' ' ' SER . 9.1 p80 -49.79 -41.22 43.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.355 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 11.2 t -61.86 -45.09 95.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.185 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.637 ' O ' HD13 ' A' ' 190' ' ' LEU . 94.8 mtt-85 -61.16 -45.12 95.93 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.071 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 31.6 m-70 -64.27 -35.41 80.75 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.028 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 55.2 m -62.32 -43.93 97.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.985 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -62.71 -41.08 98.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.7 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.637 HD13 ' O ' ' A' ' 186' ' ' ARG . 9.5 mp -62.12 -42.92 99.71 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.623 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.525 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 23.7 mmtp -67.51 -39.54 85.14 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 83.0 tt0 -67.79 -47.68 68.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.997 0.427 . . . . 0.0 111.66 -179.044 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.554 ' HZ2' ' HA ' ' A' ' 190' ' ' LEU . 1.0 OUTLIER -73.13 -43.12 62.08 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.415 -179.315 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.741 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.94 -42.09 77.21 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.053 -179.648 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.534 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -64.51 -39.25 93.43 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.43 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 49.9 m -60.46 -43.76 96.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.41 -43.23 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.9 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -62.3 -41.53 98.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.847 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -63.6 -38.52 91.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.579 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.87 -48.83 84.13 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.8 mt -62.84 -39.71 95.22 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.129 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.566 ' HB3' HH12 ' A' ' 206' ' ' ARG . 48.8 m-20 -62.31 -37.45 85.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.482 0.658 . . . . 0.0 109.419 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.419 ' C ' ' HD2' ' A' ' 203' ' ' ARG . 4.1 tmm_? -61.66 -41.96 98.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.145 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.721 HD21 ' OE1' ' A' ' 141' ' ' GLU . 21.5 mt -61.14 -39.62 90.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.434 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -60.95 -43.72 98.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.746 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.68 ' O ' ' N ' ' A' ' 210' ' ' GLN . 84.7 mtt85 -64.54 -39.8 94.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.234 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.604 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.1 t -63.62 -45.58 97.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.077 0.465 . . . . 0.0 110.236 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.06 -29.55 64.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.72 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -96.85 -16.75 20.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.274 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.68 ' N ' ' O ' ' A' ' 206' ' ' ARG . 18.8 mm100 -127.66 -37.89 1.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.781 0.324 . . . . 0.0 110.697 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.604 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -66.57 3.16 3.82 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.442 ' OH ' ' HB2' ' A' ' 124' ' ' ALA . 2.5 m-85 -91.68 168.74 11.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.882 0.372 . . . . 0.0 110.502 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 7.0 m -72.01 -5.62 36.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.429 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 35.1 p -68.67 142.33 55.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.592 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.419 ' O ' ' HB3' ' A' ' 216' ' ' ALA . 76.1 mt-10 -138.78 151.96 47.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.928 0.394 . . . . 0.0 110.301 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 216' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 215' ' ' GLU . . . 64.93 121.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.862 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -146.84 15.85 1.22 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.577 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.514 ' CD1' HG21 ' A' ' 224' ' ' ILE . 77.3 m-85 -62.12 -141.06 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 121.049 0.452 . . . . 0.0 110.125 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.569 ' HB3' HG11 ' A' ' 223' ' ' VAL . 47.6 tp10 -57.44 -43.54 84.01 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 119.931 -0.707 . . . . 0.0 109.123 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.666 ' O ' HG12 ' A' ' 223' ' ' VAL . 18.2 tt0 -170.21 131.39 0.95 Allowed Pre-proline 0 CA--C 1.533 0.305 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.778 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.419 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 76.5 Cg_exo -47.17 79.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.668 2.245 . . . . 0.0 112.233 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.564 ' N ' ' O ' ' A' ' 220' ' ' GLU . 0.7 OUTLIER 165.38 -46.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.606 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 1.046 HG13 ' H ' ' A' ' 224' ' ' ILE . 2.1 p -61.48 -84.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.42 0.629 . . . . 0.0 111.228 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 1.046 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.1 mp -52.97 -26.66 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.062 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -63.15 -46.45 87.12 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.326 0.584 . . . . 0.0 109.864 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 17.5 mt -61.76 -40.75 96.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.362 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.437 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 40.8 m0 -61.24 -37.1 81.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.957 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 228' ' ' ASP . . . . . 0.498 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 66.4 t0 -63.48 -37.17 86.28 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' A' ' 230' ' ' ALA . 95.7 mt -64.53 -42.24 95.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.442 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.587 ' O ' ' N ' ' A' ' 233' ' ' ALA . . . -29.97 -70.25 0.06 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.298 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 0.8 OUTLIER -38.0 -47.82 1.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.444 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.443 ' N ' ' O ' ' A' ' 229' ' ' LEU . 6.2 m -86.17 31.88 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.357 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 233' ' ' ALA . . . . . 0.587 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -150.51 111.06 4.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 234' ' ' ASN . . . . . 0.666 ' O ' ' HB2' ' A' ' 235' ' ' LEU . 65.0 t30 48.12 -142.6 0.48 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.228 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' A' ' 234' ' ' ASN . 60.6 mt 85.93 148.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.926 0.766 . . . . 0.0 110.746 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.624 ' H ' ' CD ' ' A' ' 239' ' ' GLU . 0.9 OUTLIER -100.23 -119.86 0.16 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.511 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 237' ' ' ASP . . . . . 0.568 ' N ' ' OE1' ' A' ' 239' ' ' GLU . 32.6 p-10 -122.06 -62.49 1.39 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.864 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.67 -42.16 99.48 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.185 0.517 . . . . 0.0 110.794 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.747 ' HB2' ' ND1' ' A' ' 320' ' ' HIS . 3.2 pm0 -58.5 -29.19 66.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.691 179.22 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.588 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -67.17 -57.89 5.9 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.002 -179.153 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -55.37 -49.45 72.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.515 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.41 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.059 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 1.5 t80 -62.12 -44.86 95.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.238 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 59.4 ttm-85 -57.9 -48.54 79.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.972 0.415 . . . . 0.0 110.355 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.5 -39.27 85.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.628 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -58.9 -55.02 40.57 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.331 0.586 . . . . 0.0 110.344 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.443 ' CD2' ' N ' ' A' ' 247' ' ' LEU . 3.9 mm? -63.91 -34.31 77.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.71 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.7 tttt -57.73 -43.15 85.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 110.265 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -68.57 -43.59 76.25 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.351 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.6 -47.66 82.8 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.504 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.71 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.5 pp20? -60.82 -38.0 83.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.079 0.466 . . . . 0.0 109.756 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.01 -39.07 89.96 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.495 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -63.17 -47.43 82.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.487 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.446 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.3 tt -63.36 -34.83 69.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.072 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.77 -45.44 89.76 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.179 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.02 -43.35 99.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.139 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -43.44 79.41 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.015 0.436 . . . . 0.0 109.976 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -61.02 -41.29 96.27 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.311 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -58.93 -46.28 88.36 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.107 0.479 . . . . 0.0 110.355 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -61.18 -40.84 95.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.119 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 261' ' ' GLN . . . . . 0.436 ' OE1' HG21 ' A' ' 297' ' ' THR . 20.7 mm100 -56.47 -44.15 80.29 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.011 0.434 . . . . 0.0 110.089 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.3 -45.32 94.97 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.059 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -60.06 -38.32 82.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.11 -42.39 99.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.373 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -61.17 -47.55 85.67 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.058 0.456 . . . . 0.0 110.476 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.239 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.68 88.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 29.7 t60 -60.53 -49.21 78.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.357 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -62.7 -44.87 95.13 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.53 -39.8 92.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.566 HD21 ' OE2' ' A' ' 275' ' ' GLU . 4.2 tt -60.72 -45.43 94.26 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.448 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -61.78 -40.23 94.44 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.55 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 12.1 m80 -71.34 -41.39 69.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.914 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -67.97 -41.64 82.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.985 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 275' ' ' GLU . . . . . 0.566 ' OE2' HD21 ' A' ' 271' ' ' LEU . 92.5 mt-10 -56.94 -17.62 10.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.57 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 29.5 m -61.16 -43.99 98.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.628 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.519 HG13 ' N ' ' A' ' 279' ' ' ASP . 2.1 p -66.87 -35.9 75.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.507 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 76.69 37.65 34.0 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 279' ' ' ASP . . . . . 0.519 ' N ' HG13 ' A' ' 277' ' ' VAL . 59.9 t0 -59.79 -44.0 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.845 0.355 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 81.87 -4.12 76.51 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -94.04 -69.9 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.905 0.383 . . . . 0.0 110.375 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -70.77 -20.84 62.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.773 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 58.6 t -62.04 -47.83 91.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.587 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 46.5 t -63.94 -44.53 92.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.047 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.8 -42.31 99.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.649 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 286' ' ' SER . . . . . 0.421 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 39.9 t -62.32 -46.72 87.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.628 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -64.58 -39.55 93.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.949 0.404 . . . . 0.0 110.742 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -58.66 -58.11 10.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.153 0.502 . . . . 0.0 110.167 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.491 ' HD3' HD23 ' A' ' 292' ' ' LEU . 35.2 mmtt -64.47 -31.98 73.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.901 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 290' ' ' HIS . . . . . 0.421 ' HB2' ' O ' ' A' ' 286' ' ' SER . 58.1 t-80 -54.49 -51.34 65.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.865 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.32 82.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.462 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.491 HD23 ' HD3' ' A' ' 289' ' ' LYS . 15.6 tp -62.04 -49.63 75.24 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.779 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.85 -41.67 99.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.941 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.465 ' O ' ' OG1' ' A' ' 297' ' ' THR . 68.8 mm-40 -61.09 -38.06 84.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.078 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.9 -45.22 96.13 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 16.8 tpp85 -61.21 -43.46 98.85 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.693 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 31.5 p -60.22 -43.5 95.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.433 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -63.89 -45.12 90.8 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.449 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.39 -40.78 97.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.267 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -44.08 97.64 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.186 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.8 -41.28 97.55 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -61.35 -46.03 91.94 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.157 0.503 . . . . 0.0 110.719 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 303' ' ' THR . . . . . 0.484 HG22 ' ND1' ' A' ' 307' ' ' HIS . 19.7 m -60.8 -44.38 96.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.56 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -61.08 -43.16 95.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.346 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.22 -49.55 76.66 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.111 0.481 . . . . 0.0 110.803 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -62.13 -44.37 96.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.458 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.484 ' ND1' HG22 ' A' ' 303' ' ' THR . 19.4 m80 -66.82 -31.09 71.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.151 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.552 HD21 HG23 ' A' ' 223' ' ' VAL . 0.5 OUTLIER -60.07 -47.9 83.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.064 -179.6 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.49 -44.14 71.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.808 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 310' ' ' ASP . . . . . 0.488 ' O ' ' NH1' ' A' ' 319' ' ' ARG . 95.4 m-20 -59.68 -51.93 67.67 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.013 0.435 . . . . 0.0 111.089 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 315' ' ' ILE . 36.4 mt -62.57 -48.21 80.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.783 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 8.0 m -69.52 -12.89 62.02 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.693 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -79.57 -64.43 1.9 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.456 ' HB2' HH11 ' A' ' 319' ' ' ARG . 89.5 mmt-85 -68.76 -37.6 79.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.01 0.405 . . . . 0.0 110.972 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.708 HD13 ' O ' ' A' ' 318' ' ' ALA . 1.2 mm -57.5 -19.88 12.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.748 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 316' ' ' SER . . . . . 0.467 ' C ' ' O ' ' A' ' 315' ' ' ILE . 82.0 p -36.67 -33.8 0.06 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.505 HH11 ' HB3' ' A' ' 318' ' ' ALA . 0.1 OUTLIER -114.22 -36.56 4.66 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.924 177.788 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.788 ' HB1' ' CD2' ' A' ' 320' ' ' HIS . . . -176.42 -71.4 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.777 ' O ' ' ND1' ' A' ' 320' ' ' HIS . 40.0 ttt85 72.3 -76.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.221 0.534 . . . . 0.0 111.702 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 320' ' ' HIS . . . . . 0.788 ' CD2' ' HB1' ' A' ' 318' ' ' ALA . 0.0 OUTLIER 53.62 -49.55 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.815 -179.745 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.758 ' N ' ' O ' ' A' ' 319' ' ' ARG . 9.6 t-20 144.49 -12.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -68.11 -34.95 77.33 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.358 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.6 HD22 ' HA ' ' A' ' 319' ' ' ARG . 9.1 mp . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.058 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 4' ' ' GLU . 87.0 p -157.18 159.08 37.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.464 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.466 ' C ' ' O ' ' A' ' 2' ' ' SER . 88.8 mtm180 33.34 32.3 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.516 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.543 ' N ' ' O ' ' A' ' 2' ' ' SER . 16.8 pt-20 -65.88 -39.95 91.13 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.77 0.319 . . . . 0.0 110.521 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.9 tttm -163.51 153.89 15.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.469 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -67.79 131.13 44.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.204 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -138.44 130.48 15.86 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.499 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.51 157.71 48.66 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.395 2.063 . . . . 0.0 112.391 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.1 tptt 55.41 76.22 0.53 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.791 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.48 157.62 52.58 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.439 2.092 . . . . 0.0 112.167 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.9 t -161.04 74.44 2.61 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.713 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -61.2 145.01 99.13 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.858 2.372 . . . . 0.0 112.164 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -136.4 117.12 14.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.503 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 16' ' ' SER . 34.4 ptt-85 -163.44 -158.69 0.48 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.644 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.09 53.3 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.841 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.529 ' N ' ' O ' ' A' ' 14' ' ' ARG . 17.4 m -75.06 148.71 39.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.194 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -132.6 64.56 0.6 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.086 -0.805 . . . . 0.0 111.086 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -125.07 112.98 17.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.847 0.356 . . . . 0.0 110.543 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 57.0 mp0 -99.42 -8.91 24.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.48 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -136.09 165.28 26.08 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.966 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.507 HH21 ' CD ' ' A' ' 53' ' ' GLU . 80.4 mtm180 -64.19 -36.61 84.62 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.505 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 30.6 mtp -125.0 147.88 48.73 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.648 0.737 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.772 ' H ' ' CD ' ' A' ' 23' ' ' GLU . 2.0 pm0 -59.15 -32.03 69.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.86 -50.13 73.39 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.31 0.576 . . . . 0.0 110.588 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.8 mp -61.33 -38.74 87.99 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.286 179.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.414 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 55.1 t-20 -63.45 -37.6 87.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.333 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.36 -48.25 82.55 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.297 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.1 mm? -61.06 -42.43 98.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.115 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.567 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 54.6 t-105 -61.81 -43.53 98.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -57.55 -44.25 85.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.207 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -61.42 -41.29 96.93 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.107 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.11 87.2 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.147 0.498 . . . . 0.0 110.129 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.567 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -63.43 -37.68 88.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.075 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -59.91 -44.37 94.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.317 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.36 -39.65 94.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.381 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.46 104.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.798 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.7 mt -121.95 154.3 61.01 Favored Pre-proline 0 C--O 1.233 0.214 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.616 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -40.53 154.11 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.513 2.142 . . . . 0.0 112.377 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.5 -43.67 49.15 Favored 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.521 2.147 . . . . 0.0 112.62 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -48.34 88.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.812 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -66.23 -38.54 88.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.564 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.9 tt -63.63 -43.56 96.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.66 -47.87 76.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.757 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -66.71 -41.81 87.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.614 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.507 HD13 ' OH ' ' A' ' 88' ' ' TYR . 51.4 tp -62.54 -48.57 78.92 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.541 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -60.25 -41.63 93.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.289 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.4 90.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.744 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.409 ' OD1' ' C ' ' A' ' 48' ' ' ASP . 61.3 t0 -60.4 -53.28 59.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.394 . . . . 0.0 110.688 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.86 -39.68 95.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.206 0.527 . . . . 0.0 110.487 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -56.8 -46.79 81.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.133 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.09 -42.49 96.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.679 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -49.57 -45.58 47.9 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.507 ' CD ' HH21 ' A' ' 21' ' ' ARG . 42.1 tp10 -66.99 -36.47 82.24 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.359 -0.537 . . . . 0.0 109.599 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.59 -46.41 89.96 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -64.24 -40.08 95.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.503 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.6 -49.75 74.01 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.983 0.42 . . . . 0.0 110.259 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.82 -42.34 97.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.861 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.78 96.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -57.09 -42.66 81.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.202 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.59 -45.25 94.68 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.72 -45.43 81.89 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.256 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mp -62.36 -42.29 99.28 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.996 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -55.83 -43.99 77.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 41.1 tp -63.14 -39.49 94.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.757 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -62.64 -19.5 63.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.017 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.73 21.98 10.71 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 83.4 mt -106.44 -169.38 1.56 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.077 0.465 . . . . 0.0 110.152 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.2 t70 54.21 97.92 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.568 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -125.37 -35.85 2.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.702 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.15 -36.28 83.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.648 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 85.73 12.26 72.36 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -69.29 -36.95 77.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.737 0.303 . . . . 0.0 110.326 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -59.99 -59.58 5.19 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.961 0.41 . . . . 0.0 110.553 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 16.4 pt-20 -57.19 -40.03 76.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.129 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.41 ' N ' ' HG3' ' A' ' 74' ' ' GLU . . . -59.6 -41.31 90.06 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.257 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -63.15 -42.28 99.42 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 77' ' ' LEU . 92.4 mt -63.63 -43.68 96.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.161 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.57 -45.48 97.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.312 0.577 . . . . 0.0 110.06 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.605 ' O ' HG23 ' A' ' 83' ' ' VAL . 42.3 ttm180 -59.46 -43.1 93.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.135 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.417 ' O ' HG13 ' A' ' 84' ' ' ILE . 96.0 m-20 -62.09 -39.68 93.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.374 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.612 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.72 -48.92 79.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.312 0.577 . . . . 0.0 109.874 -179.503 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -64.54 -38.74 92.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 79' ' ' ARG . 70.4 t -63.5 -46.19 95.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.649 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.35 -49.49 83.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.313 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.62 -39.89 88.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.868 0.366 . . . . 0.0 110.788 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -58.36 -50.26 74.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.787 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.92 -43.87 97.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.806 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.507 ' OH ' HD13 ' A' ' 45' ' ' LEU . 4.8 m-85 -62.91 -27.06 69.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.311 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.35 22.64 78.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.8 mt -100.3 16.25 24.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.93 0.395 . . . . 0.0 110.612 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -80.06 -83.43 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -77.76 171.39 55.15 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.206 -0.757 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -141.14 131.51 25.15 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.723 0.297 . . . . 0.0 110.571 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.581 ' O ' ' N ' ' A' ' 96' ' ' ALA . 12.5 tttt 50.16 94.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.864 0.364 . . . . 0.0 110.293 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 96' ' ' ALA . 28.7 t70 45.86 -85.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.591 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 94' ' ' LYS . . . 175.13 170.3 0.29 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.804 0.335 . . . . 0.0 110.557 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.39 149.77 28.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.635 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -160.88 -24.28 0.06 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.409 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.5 t -86.41 100.48 9.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.859 0.361 . . . . 0.0 110.4 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 10.7 t -154.49 149.22 26.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.469 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.1 t -118.31 108.5 15.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.562 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.415 ' O ' ' O ' ' A' ' 103' ' ' SER . 85.9 m-20 -65.23 -41.26 94.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.811 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 102' ' ' ASN . 4.0 m 50.74 102.4 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.799 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.2 mp 58.17 -172.39 0.1 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.675 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 52.1 m -60.0 -43.34 95.25 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.925 0.393 . . . . 0.0 110.814 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 63.44 29.99 76.24 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 11.9 p -72.16 136.31 46.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.811 0.338 . . . . 0.0 110.755 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -137.43 125.76 23.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.336 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -98.06 137.48 36.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.685 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -65.68 -40.55 92.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.556 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 179.76 -85.83 0.07 OUTLIER Glycine 0 N--CA 1.463 0.438 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 112' ' ' LEU . 33.8 tp -141.31 130.81 23.87 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.618 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.427 ' O ' ' CG ' ' A' ' 114' ' ' ASP . 91.7 m-20 -80.76 61.85 4.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.427 ' CG ' ' O ' ' A' ' 113' ' ' ASP . 13.6 m-20 -163.77 86.97 1.22 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.487 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -49.55 -33.7 31.53 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.63 2.22 . . . . 0.0 112.192 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -64.35 -41.38 96.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.942 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 80.8 mt -81.74 -27.07 34.03 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.151 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -54.56 -28.68 47.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.476 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.8 mttt -62.37 -48.14 81.1 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.795 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.53 -44.41 78.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.439 . . . . 0.0 112.013 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.683 ' CE2' HD13 ' A' ' 135' ' ' LEU . 10.3 t-105 -56.54 -53.67 54.83 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.795 -178.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -67.6 -31.8 72.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.49 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.586 ' O ' ' OG ' ' A' ' 127' ' ' SER . 13.8 tptt -57.33 -50.68 72.19 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.052 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.09 -46.84 64.04 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.806 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -50.6 -48.08 57.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.004 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.2 m -85.05 -39.35 18.1 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.603 ' O ' ' CE2' ' A' ' 212' ' ' TYR . 17.0 m -45.75 -30.86 1.76 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.096 -178.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -152.67 -90.17 0.08 OUTLIER Glycine 0 N--CA 1.464 0.541 0 C-N-CA 119.993 -1.099 . . . . 0.0 111.184 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.78 23.3 0.06 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.444 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -67.5 50.48 0.05 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.401 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.476 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.3 m -104.3 118.48 36.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.013 0.435 . . . . 0.0 111.812 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 111.94 -98.04 0.97 Allowed Glycine 0 CA--C 1.53 1.008 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.531 178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.535 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 12.8 pt-20 -73.78 -42.16 61.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.213 0.53 . . . . 0.0 111.149 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.458 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.7 mp0 -59.24 -48.29 82.18 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.258 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.683 HD13 ' CE2' ' A' ' 121' ' ' TRP . 3.0 mt -62.08 -40.48 95.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.127 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.535 ' OD2' ' HA ' ' A' ' 133' ' ' GLU . 0.0 OUTLIER -62.12 -39.31 92.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.075 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -63.1 -43.94 97.08 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 110.02 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.8 mm? -59.95 -42.21 93.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -33.54 76.14 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.69 177.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.589 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 82.0 mmt-85 -58.67 -41.48 86.25 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.67 -40.55 76.34 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.568 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -58.93 -58.45 8.58 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.137 0.494 . . . . 0.0 110.481 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.47 -36.97 77.01 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.049 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.589 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 49.0 m170 -54.17 -42.4 69.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.582 ' O ' HG12 ' A' ' 149' ' ' VAL . 4.6 m-70 -65.98 -36.81 84.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 178.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.85 -45.89 90.99 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.47 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.7 pt-20 -71.42 -47.89 53.05 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.412 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.435 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 49.0 mtmt -63.2 -46.64 86.08 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.178 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.582 HG12 ' O ' ' A' ' 145' ' ' HIS . 6.5 p -62.86 -36.5 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.224 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.696 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.1 OUTLIER -65.33 -40.6 93.88 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.402 179.158 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 155' ' ' LEU . 79.2 mm-40 -64.27 -39.87 94.82 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.534 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.445 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 22.1 m-85 -62.54 -49.13 76.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ASN . . . . . 0.535 ' OD1' ' HA ' ' A' ' 150' ' ' HIS . 0.9 OUTLIER -74.57 -42.57 58.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.003 0.43 . . . . 0.0 111.004 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 150' ' ' HIS . 70.8 t -61.61 -45.65 98.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.892 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.413 ' CG ' ' O ' ' A' ' 151' ' ' GLU . 77.9 mt -64.26 -42.57 96.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.197 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 18.3 mt -62.68 -43.54 98.54 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.671 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' GLU . . . . . 0.405 ' O ' ' OG ' ' A' ' 160' ' ' SER . 96.6 mt-10 -68.36 -27.61 66.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.034 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 57.9 m -69.68 -48.77 58.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.172 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 pp -78.21 -24.56 47.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.661 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.405 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 85.2 p -58.02 -38.57 76.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.384 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -65.75 -39.74 91.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.755 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 3.2 m -81.3 36.57 0.42 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.696 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -123.44 -40.98 2.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.946 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 76.3 tt0 -85.4 23.46 1.32 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.356 0.598 . . . . 0.0 110.07 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.683 ' O ' HG23 ' A' ' 165' ' ' ILE . 7.0 tp -56.81 92.24 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.6 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 m170 50.42 25.03 1.75 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.129 0.49 . . . . 0.0 109.974 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.19 91.98 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.593 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -114.13 21.08 15.1 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.576 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 59.8 t -116.95 127.76 74.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.843 0.354 . . . . 0.0 110.448 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 170' ' ' ILE . 19.6 tt -141.78 132.33 25.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.598 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.91 160.08 41.47 Favored Pre-proline 0 N--CA 1.456 -0.16 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.275 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.608 ' O ' ' O ' ' A' ' 173' ' ' SER . 62.8 Cg_exo -47.13 -54.46 4.99 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.498 2.132 . . . . 0.0 112.31 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.608 ' O ' ' O ' ' A' ' 172' ' ' PRO . 1.0 OUTLIER 44.45 111.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.991 0.424 . . . . 0.0 110.627 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -54.12 -41.02 67.87 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 177' ' ' ASP . 1.8 tt -153.56 104.45 2.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.401 ' N ' HD23 ' A' ' 175' ' ' LEU . 14.8 t 50.15 -85.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.769 0.319 . . . . 0.0 110.407 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.561 ' N ' ' O ' ' A' ' 175' ' ' LEU . 45.9 p-10 -162.76 24.46 0.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.916 0.389 . . . . 0.0 110.85 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.669 HD12 ' O ' ' A' ' 178' ' ' ILE . 1.1 pp -146.64 159.51 10.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.923 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -88.58 46.83 1.42 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.398 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 78.89 12.09 84.53 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 12.4 t -62.63 -44.25 96.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.789 0.328 . . . . 0.0 110.683 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.701 HG12 ' H ' ' A' ' 183' ' ' LEU . 2.1 t -141.24 -144.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.611 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.701 ' H ' HG12 ' A' ' 182' ' ' VAL . 5.3 tp 63.91 -36.31 0.17 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.154 0.502 . . . . 0.0 110.828 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.609 ' H ' ' C ' ' A' ' 182' ' ' VAL . 4.3 p-80 -56.11 -41.0 74.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.715 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.496 ' N ' ' CG ' ' A' ' 184' ' ' HIS . 10.7 t -60.64 -45.16 95.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.456 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.74 -45.49 93.72 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.84 0.353 . . . . 0.0 110.749 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 31.4 m-70 -66.79 -34.81 78.64 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.243 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' THR . . . . . 0.436 ' CG2' ' OE2' ' A' ' 192' ' ' GLU . 54.6 m -61.95 -43.87 97.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.169 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -65.12 -40.52 94.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.114 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 3.6 mt -62.15 -46.25 89.82 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.882 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 66.2 mttm -71.73 -40.71 69.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.442 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.436 ' OE2' ' CG2' ' A' ' 188' ' ' THR . 94.1 mt-10 -68.51 -43.76 76.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.827 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.467 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 22.6 pttt -72.31 -43.81 63.64 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.215 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.812 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.02 -42.9 72.38 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.777 -179.204 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.526 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -66.03 -37.05 84.9 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 57.7 m -59.37 -42.55 91.91 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.41 ' OD1' ' C ' ' A' ' 198' ' ' ASN . 32.8 t-20 -62.54 -42.53 99.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.768 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -64.93 -34.15 77.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.381 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.05 -46.79 92.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.281 -1.127 . . . . 0.0 110.281 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 204' ' ' LEU . 30.2 mt -62.69 -42.26 99.54 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.376 -0.53 . . . . 0.0 109.946 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -62.88 -36.66 84.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.471 ' HD2' ' O ' ' A' ' 203' ' ' ARG . 15.4 tpt180 -64.23 -41.56 96.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.821 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.507 HD12 HD23 ' A' ' 201' ' ' LEU . 81.9 mt -59.25 -38.52 80.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -65.58 -42.15 92.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.623 ' O ' ' N ' ' A' ' 210' ' ' GLN . 79.1 mtt85 -65.74 -36.74 84.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.087 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.651 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.33 -45.99 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.04 0.448 . . . . 0.0 110.127 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 90.0 p -70.25 -27.25 64.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.539 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -98.06 -14.22 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.623 ' N ' ' O ' ' A' ' 206' ' ' ARG . 53.3 tt0 -137.17 -36.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.775 0.322 . . . . 0.0 110.745 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.651 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -66.88 33.84 0.18 Allowed Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.603 ' CE2' ' O ' ' A' ' 127' ' ' SER . 23.9 t80 -61.19 -44.53 97.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.096 0.474 . . . . 0.0 110.03 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 176.95 -71.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.731 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 66.0 p 47.94 19.39 0.18 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.925 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 45.3 -165.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.656 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' ALA . . . . . 0.495 ' O ' ' CB ' ' A' ' 217' ' ' GLU . . . -101.61 -69.14 0.79 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.977 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.525 ' O ' ' C ' ' A' ' 218' ' ' PHE . 23.0 tp10 83.87 8.96 0.54 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.693 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.525 ' C ' ' O ' ' A' ' 217' ' ' GLU . 72.5 m-85 24.77 86.15 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.884 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -176.37 -28.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.187 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.631 ' O ' ' O ' ' A' ' 221' ' ' PRO . 3.1 tm-20 -59.19 128.91 85.99 Favored Pre-proline 0 C--N 1.329 -0.325 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.236 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.668 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 76.8 Cg_exo -47.09 -155.9 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.611 2.207 . . . . 0.0 111.772 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.668 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 83.5 mtp180 85.81 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.71 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.618 HG13 ' N ' ' A' ' 224' ' ' ILE . 7.5 p -61.07 -51.71 70.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.618 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.6 OUTLIER -64.35 -32.72 58.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.332 0.586 . . . . 0.0 109.516 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -63.25 -39.35 94.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.477 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.522 ' HA ' HD12 ' A' ' 229' ' ' LEU . 10.7 mt -61.29 -40.89 95.83 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.577 ' CH2' HD23 ' A' ' 308' ' ' LEU . 43.6 m0 -59.61 -40.08 86.33 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.029 -0.668 . . . . 0.0 110.057 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 228' ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 49.6 m-20 -63.52 -36.94 85.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.654 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.599 ' C ' ' H ' ' A' ' 231' ' ' GLN . 13.0 mt -63.85 -41.07 97.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.311 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -59.2 4.95 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.974 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.714 ' O ' HD21 ' A' ' 240' ' ' LEU . 5.4 pt20 -64.27 -40.96 97.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.839 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 18.8 p -154.03 23.39 0.5 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.522 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -60.87 -47.63 85.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.677 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -176.9 65.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.55 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 235' ' ' LEU . 94.1 mt -133.42 157.11 46.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.083 0.468 . . . . 0.0 110.675 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 22.0 p -78.95 171.23 15.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.49 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -64.55 -45.25 87.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.996 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.91 -45.61 92.99 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.25 0.548 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.455 ' HG2' ' HA ' ' A' ' 322' ' ' GLU . 95.8 mt-10 -64.64 -33.79 76.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.696 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.714 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -63.04 -42.8 99.83 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.508 -179.94 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 241' ' ' GLU . . . . . 0.582 ' OE2' ' NH2' ' A' ' 244' ' ' ARG . 53.1 tp10 -63.73 -47.72 79.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.197 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.95 -42.75 99.47 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.359 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.587 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.1 OUTLIER -69.87 -30.27 67.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.447 179.406 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 244' ' ' ARG . . . . . 0.582 ' NH2' ' OE2' ' A' ' 241' ' ' GLU . 57.8 ttp180 -65.03 -58.61 5.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.089 0.471 . . . . 0.0 110.691 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -66.32 -39.38 89.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.088 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -57.74 -55.88 29.09 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.304 0.574 . . . . 0.0 110.495 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 247' ' ' LEU . 3.8 mm? -63.77 -33.2 75.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.386 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.641 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.8 tttt -58.75 -42.74 89.57 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.28 0.562 . . . . 0.0 110.272 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 249' ' ' HIS . . . . . 0.407 ' O ' ' HD3' ' A' ' 253' ' ' LYS . 6.4 m-70 -68.89 -43.67 74.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.241 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -61.27 -50.16 74.16 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.433 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.6 pp20? -60.24 -37.13 79.41 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.7 81.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.548 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 253' ' ' LYS . . . . . 0.407 ' HD3' ' O ' ' A' ' 249' ' ' HIS . 13.9 mptt -63.55 -48.64 76.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.36 -38.99 83.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.058 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -59.44 -54.7 43.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.291 0.567 . . . . 0.0 110.434 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -63.43 -40.6 97.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.915 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 257' ' ' HIS . . . . . 0.485 ' NE2' ' O ' ' A' ' 297' ' ' THR . 28.4 t-80 -54.28 -47.2 72.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.12 0.486 . . . . 0.0 109.967 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 258' ' ' ASN . . . . . 0.4 ' O ' ' HB2' ' A' ' 261' ' ' GLN . 60.4 t-20 -61.64 -41.07 96.98 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.174 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -56.34 -45.5 80.36 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 121.098 0.475 . . . . 0.0 109.947 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -63.79 -34.91 78.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.049 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 261' ' ' GLN . . . . . 0.467 ' HG3' ' O ' ' A' ' 257' ' ' HIS . 26.6 mt-30 -58.57 -47.59 83.75 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -61.58 -45.87 92.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.103 0.478 . . . . 0.0 109.754 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -64.85 -33.07 75.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.006 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 47.2 tp -62.36 -43.78 98.01 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.92 0.391 . . . . 0.0 110.268 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -65.91 -46.01 79.84 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.208 0.527 . . . . 0.0 110.444 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.18 -43.63 98.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.311 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.99 86.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.135 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.69 -45.55 93.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -60.08 -48.99 79.43 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.217 0.532 . . . . 0.0 110.65 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -62.15 -39.2 91.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.56 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.635 HD23 ' O ' ' A' ' 271' ' ' LEU . 4.8 tt -60.49 -44.26 96.14 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.965 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 63.0 ttm-85 -60.2 -43.12 96.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.157 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -66.48 -39.84 89.0 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.651 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.35 84.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 275' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 271' ' ' LEU . 96.1 mt-10 -49.64 -19.18 0.55 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.848 0.356 . . . . 0.0 110.396 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 276' ' ' SER . . . . . 0.754 ' O ' ' N ' ' A' ' 278' ' ' GLY . 58.6 m -82.81 -75.89 0.29 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.814 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.506 ' C ' ' O ' ' A' ' 276' ' ' SER . 44.1 t 24.29 -77.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 O-C-N 123.686 0.616 . . . . 0.0 110.831 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.754 ' N ' ' O ' ' A' ' 276' ' ' SER . . . 161.17 -77.67 0.17 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.287 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -86.55 123.05 31.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.883 0.373 . . . . 0.0 110.474 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -67.64 144.1 43.24 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -174.92 -46.42 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -96.1 -6.09 39.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.723 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 67.0 t -62.22 -46.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.512 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.39 -46.19 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.071 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.38 -45.41 94.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.5 t -62.11 -42.82 99.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.635 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -63.22 -40.94 98.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.79 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -60.71 -54.31 46.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.364 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.63 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.8 mmtm -65.09 -33.81 76.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.158 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -57.92 -49.01 78.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.271 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -70.07 -38.22 75.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.747 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.63 HD23 ' HD3' ' A' ' 289' ' ' LYS . 2.7 tp -61.62 -50.24 73.37 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.254 -0.579 . . . . 0.0 110.175 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.55 -41.97 98.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.008 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -62.23 -42.46 99.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.19 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -60.93 -47.77 89.59 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 20.3 tpp85 -61.9 -37.34 84.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.437 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.485 ' O ' ' NE2' ' A' ' 257' ' ' HIS . 3.6 m -59.64 -52.24 66.37 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.399 0.618 . . . . 0.0 110.189 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.14 -39.26 92.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -58.23 -45.64 87.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.294 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -44.11 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.132 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -54.96 -44.29 82.62 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 302' ' ' TYR . . . . . 0.416 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 43.5 t80 -62.49 -43.37 98.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.129 0.49 . . . . 0.0 110.665 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 303' ' ' THR . . . . . 0.627 HG22 ' ND1' ' A' ' 307' ' ' HIS . 17.9 m -59.08 -44.76 91.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.578 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.06 -41.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.202 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -56.52 -57.09 13.83 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-O 121.44 0.638 . . . . 0.0 111.075 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 306' ' ' LYS . . . . . 0.416 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 4.7 mtpt -62.41 -39.94 94.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.723 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.627 ' ND1' HG22 ' A' ' 303' ' ' THR . 4.6 m80 -64.24 -35.7 81.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.106 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.577 HD23 ' CH2' ' A' ' 227' ' ' TRP . 15.4 mt -61.81 -43.93 97.86 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.397 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -67.32 -45.73 75.59 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.998 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.54 -49.67 75.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.963 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.468 ' HA ' HD23 ' A' ' 311' ' ' LEU . 21.9 mt -63.85 -40.63 97.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.856 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 69.4 m -57.7 -43.8 85.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.358 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.49 -43.38 86.94 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 317' ' ' ARG . 7.0 mpt_? -63.66 -45.64 89.22 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.773 0.321 . . . . 0.0 111.058 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -73.17 -23.35 19.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.126 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 38.4 t -59.18 -43.71 92.18 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 314' ' ' ARG . 10.8 tpp180 -117.02 124.59 49.67 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -115.96 101.35 8.69 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.386 -0.525 . . . . 0.0 112.116 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -78.4 160.43 27.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.582 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.19 4.21 6.01 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.449 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' A' ' 323' ' ' LEU . 10.2 t-20 -118.28 148.23 42.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.212 -0.904 . . . . 0.0 108.578 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.709 ' H ' ' CD ' ' A' ' 322' ' ' GLU . 5.7 mp0 -61.06 78.98 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.575 ' N ' ' O ' ' A' ' 321' ' ' ASN . 0.7 OUTLIER . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 117.983 -1.008 . . . . 0.0 111.061 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.6 t -62.53 139.56 58.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.946 0.403 . . . . 0.0 110.463 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -145.0 149.14 34.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.585 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -131.57 154.08 49.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.422 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.447 ' O ' ' O ' ' A' ' 6' ' ' ASN . 99.2 mttt -128.0 155.28 44.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.323 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.447 ' O ' ' O ' ' A' ' 5' ' ' LYS . 52.6 m-20 -56.87 -153.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.953 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.543 ' N ' ' OE1' ' A' ' 7' ' ' GLN . 4.4 mp0 -123.73 83.76 54.04 Favored Pre-proline 0 CA--C 1.531 0.236 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.886 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -62.61 147.27 95.01 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.704 2.269 . . . . 0.0 112.124 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.403 ' CB ' ' NZ ' ' A' ' 9' ' ' LYS . 9.3 mtpm? -130.94 62.03 63.09 Favored Pre-proline 0 N--CA 1.462 0.171 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.65 154.33 59.6 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 122.924 2.416 . . . . 0.0 112.174 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.572 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.2 OUTLIER -94.63 -43.9 0.29 Allowed Pre-proline 0 C--N 1.332 -0.178 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.903 -179.787 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 11' ' ' SER . 24.6 Cg_exo -61.48 145.58 97.83 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.481 2.121 . . . . 0.0 111.845 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -158.52 -46.22 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.588 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.2 ptt-85 -66.14 -38.53 88.36 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -59.09 -16.9 21.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.612 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -65.69 146.07 55.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.649 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 164.69 132.96 1.42 Allowed Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -127.13 131.58 50.76 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.819 0.342 . . . . 0.0 110.574 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -69.65 -43.76 71.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -98.97 176.77 5.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.765 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -63.74 -39.23 93.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.816 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 93.4 mmm -125.31 153.5 43.18 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.056 0.455 . . . . 0.0 110.875 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -60.75 -37.42 81.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.572 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.6 tttp -58.06 -47.16 83.99 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.261 0.553 . . . . 0.0 110.615 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.05 -39.78 93.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.359 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -64.06 -38.66 91.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.11 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.3 -46.37 88.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.433 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 28' ' ' LEU . 97.0 mt -61.7 -43.19 99.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.094 0.473 . . . . 0.0 109.87 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.597 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 52.6 t-105 -61.62 -43.39 98.94 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.214 0.531 . . . . 0.0 110.233 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -57.66 -42.11 82.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.029 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.58 -41.63 97.7 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.159 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.62 87.46 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.124 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.597 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -62.89 -36.99 85.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.055 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -60.99 -43.14 99.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.337 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -63.56 -39.67 95.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.384 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.81 106.94 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -130.42 154.82 81.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.795 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -37.96 155.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.776 2.317 . . . . 0.0 112.055 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.64 -39.87 11.18 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.546 2.164 . . . . 0.0 112.248 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.28 -48.68 84.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.999 0.428 . . . . 0.0 110.534 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -68.29 -39.54 82.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.711 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -62.9 -44.09 97.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.526 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.65 94.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.274 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -66.87 -46.59 74.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.648 HD12 ' OH ' ' A' ' 88' ' ' TYR . 5.2 tt -63.47 -45.78 89.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.547 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -58.39 -43.34 88.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.107 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 51' ' ' ILE . . . -63.14 -41.71 99.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.642 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -56.55 -51.64 67.81 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.917 0.389 . . . . 0.0 110.734 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.84 -38.57 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.372 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -57.79 -45.07 86.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.201 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 47' ' ' ALA . 2.2 mt -63.5 -42.67 97.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -51.67 -46.19 63.71 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.673 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -64.62 -38.7 91.89 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.908 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -61.52 -44.59 96.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.96 0.409 . . . . 0.0 110.406 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -62.3 -41.57 98.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.377 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -57.3 -49.55 75.73 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.749 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.09 -41.95 93.57 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.967 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.641 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.601 ' HA ' HD21 ' A' ' 62' ' ' LEU . 53.8 t90 -59.1 -41.98 89.41 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.096 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -63.6 -45.16 91.59 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -57.57 -51.57 68.94 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.73 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 59' ' ' TRP . 2.0 pp -65.34 -39.15 92.03 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.808 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 62' ' ' LEU . 29.1 tptp -58.25 -42.28 86.05 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 38.3 tp -63.03 -40.22 97.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.637 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.83 -23.1 67.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.076 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.8 56.56 0.85 Allowed Glycine 0 C--N 1.335 0.478 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 89.7 mt -132.48 -164.62 1.49 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.822 -0.689 . . . . 0.0 110.346 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.508 ' OD2' ' NE1' ' A' ' 59' ' ' TRP . 43.8 t0 54.23 102.39 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.414 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -113.12 -48.69 2.96 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.842 0.353 . . . . 0.0 110.67 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -62.98 -40.2 97.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.693 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 87.43 11.27 69.28 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -62.42 -31.44 72.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.696 0.284 . . . . 0.0 110.275 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.89 -52.64 64.54 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.047 0.451 . . . . 0.0 110.271 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -61.14 -42.17 98.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.08 179.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.01 90.58 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.239 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -61.19 -43.14 99.35 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.36 -44.05 97.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.39 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.53 -46.9 91.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 120.97 0.414 . . . . 0.0 110.283 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.715 ' O ' HG23 ' A' ' 83' ' ' VAL . 90.1 mtt-85 -62.88 -42.49 99.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.229 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.417 ' O ' HG13 ' A' ' 84' ' ' ILE . 33.3 t30 -64.01 -39.67 94.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.449 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.64 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.71 -48.55 81.21 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.632 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -64.86 -39.32 93.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.586 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 79' ' ' ARG . 79.4 t -62.84 -45.62 98.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.343 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -61.38 -48.61 88.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.583 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.26 -41.61 94.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.893 0.377 . . . . 0.0 110.542 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.52 89.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.721 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -63.41 -47.95 79.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.596 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.648 ' OH ' HD12 ' A' ' 45' ' ' LEU . 17.9 m-85 -68.87 -30.9 69.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.505 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.48 25.26 36.58 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.92 8.04 42.75 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.529 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 47.1 p-10 -82.89 45.97 1.05 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.394 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.68 149.07 51.5 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 111.224 -0.75 . . . . 0.0 111.224 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt -127.59 -31.4 2.48 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.664 0.269 . . . . 0.0 110.654 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -117.58 148.37 41.97 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.591 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -114.22 163.29 15.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.794 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -157.56 67.35 0.5 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.527 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -133.43 138.22 46.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.562 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -143.3 -66.21 0.37 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.571 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 4.6 t 43.95 -118.65 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.458 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 56.4 p -143.51 -159.7 1.02 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.262 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 98.6 p -131.96 157.38 44.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.394 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.608 ' O ' ' N ' ' A' ' 104' ' ' LEU . 27.6 t-20 -92.7 106.51 18.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.703 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.4 t 45.37 -84.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.794 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.608 ' N ' ' O ' ' A' ' 102' ' ' ASN . 10.5 mp -76.02 130.31 38.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.942 0.401 . . . . 0.0 110.412 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 61.3 p -64.16 -34.82 78.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.564 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 77.7 63.99 2.12 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 56.7 m -104.64 120.82 42.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.772 0.32 . . . . 0.0 110.359 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 94.1 mm-40 -128.68 45.43 2.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.314 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.425 ' O ' ' OD1' ' A' ' 110' ' ' ASP . 71.5 mm-40 -83.7 120.21 25.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.634 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 109' ' ' GLU . 73.9 m-20 -152.01 117.19 5.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.597 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.36 125.18 4.79 Favored Glycine 0 C--N 1.334 0.421 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.458 ' O ' ' CD ' ' A' ' 118' ' ' GLU . 4.7 mp -60.37 129.74 43.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.048 0.451 . . . . 0.0 110.649 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -73.07 -45.9 54.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.595 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -42.09 116.15 1.67 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.625 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -66.96 -27.66 42.71 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.219 1.946 . . . . 0.0 112.271 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -69.98 -45.74 66.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.806 0.336 . . . . 0.0 111.278 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 53.7 mt -71.02 -37.05 72.6 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.186 0.517 . . . . 0.0 110.865 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.672 ' OE1' ' NE2' ' A' ' 122' ' ' HIS . 27.0 mm-40 -56.04 -25.08 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.194 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 53.4 mttp -61.27 -49.06 78.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.28 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.584 ' O ' HD13 ' A' ' 120' ' ' LEU . 0.2 OUTLIER -69.38 -45.09 70.15 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.998 0.428 . . . . 0.0 111.622 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.652 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.6 t-105 -57.72 -49.72 75.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.324 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.672 ' NE2' ' OE1' ' A' ' 118' ' ' GLU . 12.6 m-70 -66.27 -35.6 80.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.385 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 127' ' ' SER . 14.0 tptt -55.83 -50.89 69.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.819 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.519 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.46 -47.38 64.16 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.105 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -53.98 -51.85 62.59 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.789 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -75.02 -43.91 50.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.005 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.519 ' OG ' ' HA ' ' A' ' 124' ' ' ALA . 22.4 p -46.6 -28.16 1.36 Allowed 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -178.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.49 -95.42 0.11 Allowed Glycine 0 CA--C 1.519 0.314 0 C-N-CA 119.996 -1.097 . . . . 0.0 111.525 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.04 32.23 0.08 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.563 ' CG ' ' OE1' ' A' ' 134' ' ' GLU . 3.9 m-85 -66.81 49.85 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.469 -179.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.7 m -104.11 124.11 48.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.008 0.433 . . . . 0.0 111.995 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 109.2 -97.49 1.06 Allowed Glycine 0 CA--C 1.53 0.976 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.384 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 134' ' ' GLU . 15.7 pt-20 -78.62 -43.31 26.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.858 0.361 . . . . 0.0 111.329 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.563 ' OE1' ' CG ' ' A' ' 130' ' ' PHE . 56.7 mt-10 -60.58 -51.35 69.8 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.209 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.652 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.4 mt -63.27 -42.86 99.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.502 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -61.17 -42.0 97.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.624 ' HA ' ' HE ' ' A' ' 140' ' ' ARG . 97.1 mttt -61.88 -41.1 97.48 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.167 0.508 . . . . 0.0 110.002 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.66 -41.73 91.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.445 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -66.19 -34.16 77.4 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 177.429 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.624 ' HE ' ' HA ' ' A' ' 137' ' ' LYS . 53.9 mtm180 -57.56 -45.99 84.47 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.842 -1.143 . . . . 0.0 108.202 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -71.9 -38.1 70.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.938 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -58.88 -58.25 9.45 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.786 -179.289 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.65 -40.73 95.96 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.066 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.581 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 47.6 m170 -56.74 -44.34 81.58 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.726 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 149' ' ' VAL . 3.1 m-70 -60.67 -42.39 96.98 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.606 179.123 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -60.54 -43.48 97.14 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.744 -0.383 . . . . 0.0 111.386 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 151' ' ' GLU . 98.6 mt-10 -65.98 -55.78 15.02 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.703 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.23 -42.68 99.26 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.56 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 145' ' ' HIS . 43.9 t -61.56 -45.42 98.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.144 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.659 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 1.1 p-80 -65.5 -36.27 83.35 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.931 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.602 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 94.2 mt-10 -59.39 -46.23 89.26 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.997 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -61.72 -45.18 95.06 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.684 -0.406 . . . . 0.0 109.955 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -65.65 -39.29 91.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.15 -47.84 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 62.6 mt -63.52 -42.88 98.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.51 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.453 HD21 HD21 ' A' ' 190' ' ' LEU . 34.2 mt -62.45 -42.7 99.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.539 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.75 -33.22 75.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.952 0.406 . . . . 0.0 110.264 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 65.3 m -65.21 -49.11 70.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.971 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' A' ' 159' ' ' LEU . 1.6 pp -78.95 -21.17 47.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.633 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 36.6 m -60.12 -28.51 67.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.521 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.8 mtp180 -58.11 -44.64 87.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.036 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.614 ' C ' ' H ' ' A' ' 164' ' ' GLU . 12.3 p -83.6 -179.68 7.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.365 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 65.1 -36.93 0.22 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.139 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.614 ' H ' ' C ' ' A' ' 162' ' ' THR . 80.6 tt0 -92.9 57.36 2.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.432 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 18.2 tt -134.84 143.07 38.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.082 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -81.94 109.35 16.21 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -173.62 81.04 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.26 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 48.03 98.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.95 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 51.9 t -111.3 102.69 14.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.569 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 18.8 tt -169.77 142.82 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.642 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 1.4 p -159.88 154.92 21.36 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.588 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.45 -41.86 64.78 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.57 2.18 . . . . 0.0 112.414 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.46 ' O ' ' OG ' ' A' ' 173' ' ' SER . 9.6 p 57.31 98.37 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -87.38 -23.8 24.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.696 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.659 ' O ' ' N ' ' A' ' 177' ' ' ASP . 7.1 mp -117.0 122.68 44.94 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.545 ' OG ' ' N ' ' A' ' 177' ' ' ASP . 82.0 p 43.7 -85.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.076 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.659 ' N ' ' O ' ' A' ' 175' ' ' LEU . 50.2 p30 -143.6 24.41 1.72 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.879 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 1.5 pp -138.83 156.74 28.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.433 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -62.91 -39.81 95.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.43 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 67.23 140.13 0.06 OUTLIER Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 1.7 m 174.86 -58.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.749 0.309 . . . . 0.0 110.485 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.451 ' O ' HG12 ' A' ' 182' ' ' VAL . 10.9 t -137.99 3.46 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.021 0.438 . . . . 0.0 110.627 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 20.8 mt -62.59 -39.61 94.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -44.73 -39.88 5.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.608 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 74.4 m -61.83 -44.88 95.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.387 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -65.22 -41.55 94.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.265 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -64.85 -40.92 95.93 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.114 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 61.7 m -63.45 -44.58 94.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.966 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -65.65 -41.09 92.98 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.271 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.453 HD21 HD21 ' A' ' 156' ' ' LEU . 7.6 mt -61.97 -47.54 84.38 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.444 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.493 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.6 mtmt -70.22 -37.73 75.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.939 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -67.67 -51.02 54.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.488 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 18.4 pttt -67.13 -42.9 83.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.313 -179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.712 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -70.06 -40.49 75.05 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.632 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.5 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 25.3 mmt180 -64.06 -39.5 94.22 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.244 -0.583 . . . . 0.0 109.643 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 78.4 p -62.68 -44.3 96.6 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.456 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.97 -44.4 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.91 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -63.37 -41.56 98.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.826 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 32.9 mt-30 -66.03 -29.54 69.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.123 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.59 -47.22 63.37 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 201' ' ' LEU . 32.8 mt -64.44 -42.89 95.72 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.873 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.826 ' OD1' ' O ' ' A' ' 199' ' ' GLN . 0.4 OUTLIER -65.85 -35.38 80.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.0 tmt_? -63.42 -42.93 98.74 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.19 -40.57 96.52 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -62.65 -42.66 99.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.867 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.767 ' O ' ' N ' ' A' ' 210' ' ' GLN . 67.9 mtp180 -65.23 -38.34 90.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.064 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 203' ' ' ARG . 52.9 t -64.07 -47.64 89.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.906 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.8 m -71.16 -29.5 65.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.496 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -93.93 -42.27 9.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.372 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.767 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.7 tt0 -105.04 -35.83 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.11 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.459 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . -63.07 -31.87 82.18 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.614 ' O ' ' O ' ' A' ' 213' ' ' SER . 45.6 t80 -42.78 97.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.704 0.287 . . . . 0.0 110.546 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.738 ' O ' ' O ' ' A' ' 214' ' ' THR . 27.9 t 50.11 158.98 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.134 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.738 ' O ' ' O ' ' A' ' 213' ' ' SER . 12.0 t 46.04 150.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.87 0.367 . . . . 0.0 111.01 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.442 ' HG2' ' N ' ' A' ' 216' ' ' ALA . 84.4 tt0 177.03 158.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.283 179.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 216' ' ' ALA . . . . . 0.442 ' N ' ' HG2' ' A' ' 215' ' ' GLU . . . -150.25 146.06 26.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.394 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -151.0 -6.93 0.26 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.814 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.458 ' O ' ' HB3' ' A' ' 219' ' ' GLU . 96.1 m-85 -122.29 166.33 14.82 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.458 ' HB3' ' O ' ' A' ' 218' ' ' PHE . 82.3 tt0 71.68 -8.86 1.01 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.49 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -56.06 157.47 8.52 Favored Pre-proline 0 C--O 1.232 0.178 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.912 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.484 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 35.3 Cg_exo -56.88 -171.36 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.373 2.049 . . . . 0.0 111.863 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.484 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 0.2 OUTLIER 82.82 -85.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.87 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.998 HG13 ' H ' ' A' ' 224' ' ' ILE . 4.7 p -62.46 -69.22 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.727 0 CA-C-O 121.321 0.581 . . . . 0.0 111.838 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.998 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.5 OUTLIER -56.57 -34.33 41.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 225' ' ' ASP . . . . . 0.425 ' HB2' ' N ' ' A' ' 222' ' ' ARG . 6.4 m-20 -64.42 -37.0 86.0 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.089 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.45 -42.81 96.9 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.491 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 42.7 m0 -61.73 -38.75 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.15 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -61.54 -38.28 86.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 231' ' ' GLN . 92.3 mt -64.7 -42.06 95.55 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.482 0.658 . . . . 0.0 110.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.452 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -45.38 -19.23 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.902 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.447 ' N ' ' O ' ' A' ' 229' ' ' LEU . 66.2 tt0 -75.13 -69.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.628 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.439 ' O ' ' O ' ' A' ' 233' ' ' ALA . 5.0 m -73.3 -19.05 61.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.562 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 233' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -44.04 -96.0 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.668 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -168.87 93.7 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.703 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.452 HD12 ' O ' ' A' ' 230' ' ' ALA . 85.8 mt -141.24 163.83 31.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.649 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.2 p -78.37 166.15 22.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.64 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 237' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 237' ' ' ASP . 60.0 t0 -66.07 -48.74 69.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.154 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -62.13 -46.74 87.66 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.123 0.487 . . . . 0.0 110.451 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.472 ' OE1' ' O ' ' A' ' 321' ' ' ASN . 80.4 tt0 -62.19 -40.02 94.65 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.292 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 240' ' ' LEU . 17.3 mt -65.54 -34.2 77.7 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.772 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -63.67 -51.87 63.18 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.084 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -65.36 -41.8 93.43 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.344 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.449 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.7 OUTLIER -66.25 -43.06 87.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.403 179.318 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -58.94 -47.55 84.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.195 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -68.18 -42.6 79.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.703 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -57.03 -51.4 69.4 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.13 0.49 . . . . 0.0 110.43 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 2.3 mm? -63.62 -38.92 92.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.529 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 38.4 ttpt -54.82 -45.04 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -66.14 -40.1 90.34 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.552 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 250' ' ' PHE . . . . . 0.456 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 23.5 t80 -58.07 -50.15 74.44 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.317 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 7.7 pt-20 -62.81 -36.67 83.92 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.86 -38.52 86.51 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.563 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.81 -46.57 87.36 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.243 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -66.08 -39.82 85.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.172 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.19 -46.07 92.0 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.162 0.506 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -61.66 -44.84 96.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.966 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 257' ' ' HIS . . . . . 0.483 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -54.47 -43.02 71.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 258' ' ' ASN . . . . . 0.483 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 47.2 t30 -60.8 -41.25 95.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.305 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -59.99 -48.29 82.32 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.521 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -62.32 -36.22 81.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 261' ' ' GLN . . . . . 0.538 ' OE1' HG21 ' A' ' 297' ' ' THR . 13.1 mm100 -60.58 -42.63 97.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.12 -47.56 85.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.124 0.487 . . . . 0.0 109.86 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -64.06 -35.67 81.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.922 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 62.8 tp -62.04 -41.81 98.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.954 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -63.85 -46.23 85.94 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 110.475 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 67.2 mt -62.74 -43.41 98.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.97 82.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.025 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -61.56 -46.2 90.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -58.09 -48.67 79.45 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.098 0.475 . . . . 0.0 110.119 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -62.46 -35.8 80.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.378 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 271' ' ' LEU . 3.1 tt -59.07 -44.68 91.87 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -63.84 -41.25 97.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.276 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -66.04 -45.04 82.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.659 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.611 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.32 -34.88 77.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.886 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 275' ' ' GLU . . . . . 0.544 ' OE2' HG13 ' A' ' 283' ' ' VAL . 41.6 mm-40 -57.67 -31.42 66.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.893 0.377 . . . . 0.0 110.342 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 5.4 m -87.15 6.79 31.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.926 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 274' ' ' ALA . 12.3 p -60.38 -45.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.759 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.597 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 160.25 -113.0 0.55 Allowed Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -61.32 -47.86 83.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.716 0.294 . . . . 0.0 110.654 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 280' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 135.14 -102.77 0.44 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 65.73 -60.43 0.28 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.931 0.396 . . . . 0.0 110.368 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 282' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -67.1 -17.33 64.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.281 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 283' ' ' VAL . . . . . 0.544 HG13 ' OE2' ' A' ' 275' ' ' GLU . 81.3 t -63.81 -43.3 97.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.803 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 284' ' ' SER . . . . . 0.46 ' O ' ' HG2' ' A' ' 287' ' ' ARG . 5.8 t -59.22 -45.72 90.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.156 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -69.63 -43.85 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 286' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 4.4 p -61.27 -48.6 80.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.932 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 287' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 284' ' ' SER . 34.9 ptt180 -65.58 -34.88 79.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 110.467 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.24 -65.1 0.7 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.092 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.486 ' HD3' HD23 ' A' ' 292' ' ' LEU . 25.6 mmtt -63.04 -39.21 94.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.824 -0.75 . . . . 0.0 109.961 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 290' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 286' ' ' SER . 39.7 t-80 -43.94 -55.78 4.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.076 0.465 . . . . 0.0 110.051 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.24 79.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.883 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.486 HD23 ' HD3' ' A' ' 289' ' ' LYS . 18.1 tp -59.78 -53.21 60.63 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.838 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.21 -42.26 96.68 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.253 0.549 . . . . 0.0 110.31 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.0 tt0 -61.93 -37.68 85.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.786 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.48 -43.67 97.83 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -59.45 -44.44 92.97 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.356 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.538 HG21 ' OE1' ' A' ' 261' ' ' GLN . 44.8 p -59.17 -44.61 92.16 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.654 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -62.36 -45.32 93.7 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.638 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.79 -38.88 89.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.202 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.26 96.71 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.35 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.69 -42.71 98.04 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -61.3 -44.23 97.56 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.995 0.426 . . . . 0.0 110.573 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 303' ' ' THR . . . . . 0.578 HG22 ' ND1' ' A' ' 307' ' ' HIS . 19.8 m -60.44 -43.92 96.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.656 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.83 -43.38 91.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -57.8 -51.78 68.19 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.824 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -63.61 -40.92 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.462 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.578 ' ND1' HG22 ' A' ' 303' ' ' THR . 5.8 m80 -63.62 -36.42 83.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.929 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.528 ' CD2' HG21 ' A' ' 223' ' ' VAL . 7.8 mt -62.02 -44.38 96.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.614 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.4 -47.81 69.22 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.943 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.46 -48.14 82.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 311' ' ' LEU . 25.5 mt -63.2 -39.45 94.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.576 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.2 t -58.93 -44.42 91.37 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.15 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.63 -41.75 89.1 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 317' ' ' ARG . 94.3 mtt-85 -64.41 -45.13 88.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.917 0.389 . . . . 0.0 111.233 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.9 mm -72.52 -18.03 18.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.712 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 71.8 p -50.49 -34.82 26.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 314' ' ' ARG . 0.3 OUTLIER -143.22 157.65 44.31 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 178.377 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.429 ' O ' ' O ' ' A' ' 319' ' ' ARG . . . -143.55 100.95 3.69 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 119.959 -0.697 . . . . 0.0 110.71 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' A' ' 318' ' ' ALA . 39.4 mmm-85 -43.74 175.1 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.055 -0.975 . . . . 0.0 112.235 -178.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -59.91 -50.41 73.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.196 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.472 ' O ' ' OE1' ' A' ' 239' ' ' GLU . 70.7 m-80 -94.74 -99.77 0.15 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.153 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -119.57 135.63 54.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.326 -0.455 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.904 -179.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.5 m -60.04 -42.73 95.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 51.9 69.31 0.68 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.042 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -126.04 134.0 51.56 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.496 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 6' ' ' ASN . 30.5 tptt -162.45 60.41 0.22 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.658 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.46 ' O ' ' O ' ' A' ' 5' ' ' LYS . 95.9 m-20 41.06 -165.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.542 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -144.72 146.42 31.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.63 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -68.95 -89.96 0.0 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 123.068 2.512 . . . . 0.0 113.092 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm 50.59 67.51 4.28 Favored Pre-proline 0 C--O 1.234 0.239 0 CA-C-O 120.838 0.351 . . . . 0.0 110.444 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.426 ' O ' ' CB ' ' A' ' 11' ' ' SER . 73.9 Cg_endo -73.79 -16.81 23.33 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 123.199 2.599 . . . . 0.0 113.021 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 10' ' ' PRO . 1.2 p 74.86 149.41 0.12 Allowed Pre-proline 0 C--N 1.33 -0.245 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.16 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.99 150.7 55.18 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.71 2.274 . . . . 0.0 112.15 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -158.79 113.15 2.46 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.498 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -145.99 164.61 31.52 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.142 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -139.91 146.0 38.69 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.172 0.51 . . . . 0.0 111.281 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.3 m -74.67 -87.49 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.172 -178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 79.38 9.23 87.16 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.844 -0.502 . . . . 0.0 111.844 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -68.65 136.36 52.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.648 0.261 . . . . 0.0 110.567 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -130.37 -34.74 1.58 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.902 0.382 . . . . 0.0 110.465 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -98.47 -175.88 3.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.577 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.439 ' HE ' ' HG3' ' A' ' 53' ' ' GLU . 52.5 ptt85 -91.29 -6.4 53.22 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.548 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.408 ' SD ' ' NZ ' ' A' ' 24' ' ' LYS . 3.6 mmt -137.45 144.46 42.33 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.767 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.692 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 46.6 tp10 -66.13 -53.12 41.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.465 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.408 ' NZ ' ' SD ' ' A' ' 22' ' ' MET . 8.0 pttm -51.58 -43.74 62.55 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.239 0.542 . . . . 0.0 110.322 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.2 tp -61.62 -42.95 99.61 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.386 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.723 ' OD1' ' N ' ' A' ' 27' ' ' GLN . 1.5 p-10 -65.25 -25.35 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.234 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.723 ' N ' ' OD1' ' A' ' 26' ' ' ASN . 92.2 mt-30 -69.47 -45.62 68.58 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.921 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HA ' HD13 ' A' ' 28' ' ' LEU . 4.3 mm? -61.83 -41.68 98.09 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.387 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.495 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 41.2 t-105 -61.82 -46.04 91.22 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.342 0.592 . . . . 0.0 110.399 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -57.86 -41.31 82.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.182 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -60.91 -41.76 96.75 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.183 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.93 86.85 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.205 0.526 . . . . 0.0 110.415 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.495 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 75.0 mt-30 -58.29 -39.12 78.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.241 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -62.78 -41.54 99.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.511 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.13 -34.84 77.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.262 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.57 107.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.869 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 37' ' ' LEU . 86.2 mt -129.05 154.54 80.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.572 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 74.8 Cg_exo -41.63 153.32 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.529 2.153 . . . . 0.0 112.206 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.6 Cg_exo -57.2 -47.31 23.14 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.724 2.283 . . . . 0.0 112.327 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 69.5 t -64.29 -47.19 90.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.667 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -63.2 -41.87 99.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.389 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.0 tt -62.3 -43.01 99.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.629 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.5 -41.2 96.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.453 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -69.92 -42.54 73.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.496 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.97 -48.88 78.37 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -61.84 -40.54 95.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.21 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.43 -47.0 87.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.6 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.971 ' O ' HG22 ' A' ' 51' ' ' ILE . 50.3 t0 -59.43 -49.84 76.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.119 0.485 . . . . 0.0 110.293 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.63 -41.4 99.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.1 0.476 . . . . 0.0 110.441 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.26 -47.45 85.95 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.35 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.971 HG22 ' O ' ' A' ' 48' ' ' ASP . 16.9 tt -59.51 -36.82 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.403 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 52.2 tt0 -60.96 -42.42 98.26 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.439 ' HG3' ' HE ' ' A' ' 21' ' ' ARG . 76.7 tt0 -61.07 -40.29 93.09 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.85 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -62.92 -44.29 96.48 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.728 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -60.98 -41.28 96.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.485 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -57.78 -48.49 79.54 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.005 0.431 . . . . 0.0 110.186 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.3 tp -59.99 -41.43 92.02 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.11 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.13 93.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.299 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.6 t90 -58.34 -44.97 88.95 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.067 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.58 -46.22 91.04 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.54 -41.87 86.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.181 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.12 -40.04 96.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.962 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.72 -42.98 84.91 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 39.4 mt -62.89 -40.29 97.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.103 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -64.33 -36.22 83.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.144 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.36 54.59 1.44 Allowed Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.194 -0.762 . . . . 0.0 111.194 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 67' ' ' LEU . 75.3 mt -119.53 -56.35 2.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.757 0.313 . . . . 0.0 110.598 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -71.39 136.8 47.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.296 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -154.95 -29.38 0.11 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.572 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -64.64 -35.61 81.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.526 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.78 -1.65 81.29 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -58.95 -36.18 74.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.359 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 73' ' ' LYS . 13.6 mptt -56.65 -68.58 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.099 0.476 . . . . 0.0 109.958 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -46.04 -38.95 8.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.16 94.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.559 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.411 ' O ' ' ND2' ' A' ' 80' ' ' ASN . 77.8 mtp85 -63.64 -38.96 93.09 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.448 ' N ' HD12 ' A' ' 77' ' ' LEU . 9.3 mp -64.32 -45.07 89.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.11 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.07 -45.91 95.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.177 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.741 ' O ' HG23 ' A' ' 83' ' ' VAL . 77.2 ttt-85 -59.57 -43.85 93.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.112 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.411 ' ND2' ' O ' ' A' ' 76' ' ' ARG . 43.5 m-80 -62.63 -39.74 94.78 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.112 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.666 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.22 -50.92 71.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.285 0.564 . . . . 0.0 110.239 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.409 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 30.0 t-20 -64.97 -37.32 87.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.699 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 79' ' ' ARG . 73.2 t -63.27 -45.88 97.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.393 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.16 -49.98 82.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.507 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.449 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.6 mm? -66.55 -42.02 87.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.019 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.24 94.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.06 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -62.38 -47.9 82.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.855 -179.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.08 -26.6 68.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.265 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.19 8.12 78.95 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.969 -0.853 . . . . 0.0 110.969 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 90' ' ' LEU . 56.5 mt -76.05 -18.52 59.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.827 0.346 . . . . 0.0 110.557 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.42 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 23.6 p-10 -65.14 -35.26 80.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.968 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -157.36 179.83 32.82 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.4 mttp -132.14 150.63 52.11 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.897 0.379 . . . . 0.0 110.347 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -130.27 76.41 1.72 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.527 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -89.92 165.36 14.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.29 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -132.53 -178.05 4.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.409 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -66.0 135.81 55.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.609 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -159.78 80.21 0.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.587 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 67.8 t -123.56 129.99 74.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.994 0.426 . . . . 0.0 110.58 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.3 m 45.09 92.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.912 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.8 t -136.99 143.41 42.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.437 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.402 ' O ' ' OD1' ' A' ' 102' ' ' ASN . 41.7 p-10 -120.49 120.97 37.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.52 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 87.9 p -62.24 -36.32 81.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.372 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.7 tp -84.03 149.97 25.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.587 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.2 p 62.28 163.38 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.357 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.13 88.92 0.07 OUTLIER Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.656 -0.977 . . . . 0.0 110.656 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.8 t -140.44 161.63 37.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.861 0.362 . . . . 0.0 110.451 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -139.74 148.05 41.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.524 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -177.4 45.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.553 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -119.06 21.78 12.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.639 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.13 -113.44 1.54 Allowed Glycine 0 N--CA 1.462 0.419 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.5 tp -142.31 1.05 1.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.751 0.31 . . . . 0.0 110.76 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.54 ' N ' ' OE2' ' A' ' 118' ' ' GLU . 50.9 t0 61.15 24.04 14.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.72 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 113' ' ' ASP . 37.7 m-20 -139.23 102.0 7.48 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.505 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -50.5 -40.97 53.96 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.566 2.177 . . . . 0.0 112.297 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -62.68 -42.26 99.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.921 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.0 mt -85.79 -36.28 20.19 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.54 ' OE2' ' N ' ' A' ' 113' ' ' ASP . 94.7 mt-10 -62.4 -28.69 69.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.505 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 11.2 mmmt -60.96 -46.62 90.0 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.574 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 120' ' ' LEU . 81.3 mt -69.35 -46.79 66.17 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 120.948 0.404 . . . . 0.0 111.796 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.45 ' CE3' HD22 ' A' ' 135' ' ' LEU . 11.9 t-105 -59.25 -47.08 86.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.605 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.43 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.3 m80 -69.73 -34.22 73.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.615 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.541 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 10.6 tptt -57.92 -52.0 67.32 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.178 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.818 ' O ' ' O ' ' A' ' 128' ' ' GLY . . . -73.61 -46.7 45.44 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.523 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.573 ' HB2' HD11 ' A' ' 135' ' ' LEU . 64.3 tttm -50.09 -39.79 43.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.669 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.463 ' C ' ' H ' ' A' ' 128' ' ' GLY . 20.8 m -97.69 -66.67 0.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.708 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 m -55.74 -7.0 0.24 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.419 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 1.153 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -160.25 98.38 0.17 Allowed Glycine 0 C--O 1.226 -0.373 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -41.98 44.78 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.355 0.598 . . . . 0.0 109.928 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 1.153 ' N ' ' O ' ' A' ' 128' ' ' GLY . 3.4 m-30 -81.05 32.09 0.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.385 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.647 ' HA ' HD12 ' A' ' 135' ' ' LEU . 6.2 m -85.13 128.45 34.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.008 0.432 . . . . 0.0 111.533 -179.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.45 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . 111.3 -98.17 1.01 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.356 177.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 74.7 mm-40 -79.17 -43.85 23.11 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.991 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.463 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.1 mp0 -62.44 -50.49 71.28 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.076 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.647 HD12 ' HA ' ' A' ' 131' ' ' SER . 2.7 mt -61.09 -42.09 97.87 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.363 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.45 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 96.2 m-20 -63.3 -37.71 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.936 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 23.1 mmtp -62.26 -44.25 96.97 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-O 121.266 0.555 . . . . 0.0 109.991 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.2 mm? -60.21 -43.47 95.93 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.247 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.481 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -65.21 -36.64 84.79 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.058 176.459 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.607 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 86.5 mtt180 -53.53 -43.79 68.66 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -70.12 -38.37 75.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.76 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.481 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.1 m-85 -59.35 -58.54 8.16 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.59 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 67.0 mt -60.79 -38.84 86.7 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.022 -0.671 . . . . 0.0 110.26 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.607 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 61.3 m170 -53.15 -43.98 67.45 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.096 -0.642 . . . . 0.0 109.706 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.461 ' ND1' HG23 ' A' ' 197' ' ' ILE . 3.3 m-70 -64.09 -39.52 94.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.658 178.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -61.75 -44.46 96.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.33 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -68.26 -51.2 47.79 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.698 0.285 . . . . 0.0 111.516 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -61.58 -43.42 98.9 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.954 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 26.1 t -62.49 -43.36 98.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.021 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.771 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -63.21 -38.51 91.45 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.67 -47.68 84.26 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.279 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.46 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 23.0 m-85 -65.8 -46.62 77.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.551 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -67.52 -43.82 79.89 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.504 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.771 HG23 ' O ' ' A' ' 150' ' ' HIS . 77.9 t -63.31 -45.48 98.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.031 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.2 mt -64.04 -42.21 97.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.519 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.421 HD21 HD21 ' A' ' 190' ' ' LEU . 20.2 mt -62.68 -45.26 93.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.641 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -67.83 -27.3 66.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.058 0.456 . . . . 0.0 110.229 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 65.4 m -67.83 -50.75 55.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.912 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.49 ' O ' ' OG1' ' A' ' 162' ' ' THR . 1.3 pp -79.46 -20.86 46.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.699 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 43.9 m -60.86 -38.12 84.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.672 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.558 ' C ' ' H ' ' A' ' 163' ' ' GLU . 76.3 mtp180 -63.28 -38.43 91.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.795 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 159' ' ' LEU . 11.8 p -67.53 35.86 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.671 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.558 ' H ' ' C ' ' A' ' 161' ' ' ARG . 86.0 tt0 -134.85 -40.52 0.77 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.09 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -100.66 28.82 4.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.251 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.706 ' O ' HG23 ' A' ' 165' ' ' ILE . 20.1 tt -55.73 110.13 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.908 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 45.5 m170 50.98 21.56 1.01 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.986 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 41.76 92.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.751 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -160.48 175.16 13.07 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.402 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 14.1 t 62.76 109.77 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 170' ' ' ILE . 10.3 tp -143.73 129.55 15.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.583 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.06 160.22 43.8 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.435 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -77.5 93.18 1.09 Allowed 'Trans proline' 0 C--N 1.307 -1.636 0 C-N-CA 122.757 2.305 . . . . 0.0 112.176 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 19.5 t -153.84 142.23 20.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.644 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -61.99 -45.11 95.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.417 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.69 HD23 ' N ' ' A' ' 175' ' ' LEU . 2.5 pt? -155.55 144.88 20.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.377 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.4 ' HB2' ' CD1' ' A' ' 183' ' ' LEU . 23.0 t 46.29 -85.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.524 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 175' ' ' LEU . 5.1 p30 -173.84 24.44 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.737 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.691 HD12 ' O ' ' A' ' 178' ' ' ILE . 1.0 OUTLIER -134.76 160.01 41.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.999 179.856 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -66.63 -38.82 87.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.376 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 161.43 14.01 0.03 OUTLIER Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 6.0 t -64.88 -23.64 67.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.789 0.328 . . . . 0.0 110.671 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.845 HG12 ' H ' ' A' ' 183' ' ' LEU . 22.9 t -137.08 178.97 4.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.676 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.845 ' H ' HG12 ' A' ' 182' ' ' VAL . 2.9 mt 65.68 -16.23 0.11 Allowed 'General case' 0 C--O 1.239 0.515 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.614 ' ND1' ' N ' ' A' ' 185' ' ' SER . 30.9 p80 -57.81 -42.72 84.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.557 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.614 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 90.0 p -62.24 -43.07 99.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.045 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.787 ' HE ' HD23 ' A' ' 183' ' ' LEU . 56.2 mtm-85 -60.62 -41.07 94.09 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.83 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -66.57 -41.2 88.93 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.172 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 55.6 m -62.84 -44.55 95.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.232 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -61.69 -40.62 95.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.141 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.626 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 7.1 mt -62.47 -43.35 99.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.866 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.6 mttm -70.67 -32.72 70.08 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.602 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.4 tt0 -68.42 -45.89 71.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.183 -178.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.626 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 7.8 ptmt -73.47 -44.61 57.62 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.498 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.78 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -65.18 -41.72 94.34 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.887 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.529 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -68.32 -36.58 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.819 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.412 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 63.8 m -61.45 -40.93 96.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.461 HG23 ' ND1' ' A' ' 145' ' ' HIS . 96.6 mt -63.53 -43.95 98.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.518 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.8 -42.25 97.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -63.97 -37.39 87.24 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.568 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.98 -43.15 99.79 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 17.5 mt -64.06 -42.26 97.06 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.201 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.69 -38.38 90.19 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.778 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.665 ' O ' HG12 ' A' ' 207' ' ' VAL . 31.7 mt -61.0 -39.01 88.07 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.413 179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 83.3 mtt-85 -64.12 -41.62 97.16 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.19 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.6 mtp180 -64.82 -42.85 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.769 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.665 HG12 ' O ' ' A' ' 204' ' ' LEU . 0.3 OUTLIER -63.77 -37.42 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.44 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.417 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 25.4 m -75.96 -26.92 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.575 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -98.29 -15.08 19.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.033 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.526 ' N ' ' O ' ' A' ' 206' ' ' ARG . 52.4 mt-30 -129.53 -39.07 1.5 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.696 -179.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -70.14 46.33 0.62 Allowed Glycine 0 CA--C 1.523 0.549 0 N-CA-C 111.392 -0.683 . . . . 0.0 111.392 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.482 ' CG ' ' N ' ' A' ' 213' ' ' SER . 20.5 t80 -89.49 -138.79 0.13 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.856 0.36 . . . . 0.0 110.333 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.772 ' O ' ' O ' ' A' ' 214' ' ' THR . 54.4 p -146.37 -62.56 0.31 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.917 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.772 ' O ' ' O ' ' A' ' 213' ' ' SER . 8.9 t 43.97 155.74 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.627 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -173.53 157.11 3.15 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.224 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.13 178.44 6.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.502 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.537 ' N ' ' OE1' ' A' ' 217' ' ' GLU . 56.1 mp0 -143.7 -11.77 0.68 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 110.017 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.559 ' CD2' HG21 ' A' ' 224' ' ' ILE . 42.2 m-85 -55.09 177.54 0.04 OUTLIER 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.504 179.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -51.43 -54.54 25.8 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -145.18 154.5 54.14 Favored Pre-proline 0 C--N 1.326 -0.431 0 C-N-CA 119.165 -1.014 . . . . 0.0 110.479 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.73 13.99 0.88 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.663 2.242 . . . . 0.0 112.147 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -124.58 -40.98 2.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.02 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 1.068 HG13 ' H ' ' A' ' 224' ' ' ILE . 5.8 p -61.47 -78.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.246 0.916 0 CA-C-O 121.42 0.629 . . . . 0.0 110.869 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 1.068 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.1 mp -58.05 -25.54 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.45 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -63.24 -46.91 84.71 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.205 0.526 . . . . 0.0 109.844 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.457 HD23 HD12 ' A' ' 229' ' ' LEU . 24.5 mt -61.48 -40.99 96.53 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.677 179.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.0 m0 -61.39 -35.58 77.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.953 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -64.86 -37.28 87.1 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.708 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.6 mt -63.41 -41.27 98.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.968 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -60.03 20.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.0 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.708 ' H ' ' C ' ' A' ' 229' ' ' LEU . 13.8 tt0 -94.26 -44.82 7.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.668 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.2 p -121.03 -0.69 9.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.622 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.33 -103.52 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.587 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -141.53 95.39 2.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.505 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 3.8 mp -137.84 160.26 39.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.95 0.405 . . . . 0.0 110.562 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 33.9 p -85.44 -157.41 0.32 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.586 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 237' ' ' ASP . . . . . 0.47 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 27.4 p-10 -96.34 -59.33 1.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.629 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 238' ' ' LYS . . . . . 0.47 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 54.4 mtmt -62.25 -44.03 97.48 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 110.697 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -60.33 -32.0 70.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.163 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.632 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -63.94 -43.24 96.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.189 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -63.73 -49.5 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.16 -38.23 85.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.042 0.449 . . . . 0.0 110.092 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.578 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.3 OUTLIER -68.21 -41.74 80.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.01 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -58.6 -52.25 66.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.96 0.41 . . . . 0.0 110.197 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.7 -42.27 95.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.577 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -56.5 -48.12 77.86 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.416 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 243' ' ' PHE . 1.4 mm? -63.49 -38.38 90.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.484 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.797 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 78.7 tttt -56.56 -44.81 81.29 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.347 0.594 . . . . 0.0 110.296 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -67.62 -38.57 84.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.488 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.35 -49.24 78.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.797 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.1 OUTLIER -60.5 -39.89 89.4 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.237 0.542 . . . . 0.0 109.873 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 252' ' ' ALA . . . . . 0.521 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.08 -36.86 84.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.266 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -62.37 -49.88 73.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.144 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.485 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.9 tt -61.91 -36.0 71.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.362 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -62.98 -45.9 90.26 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.166 0.508 . . . . 0.0 110.349 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -63.16 -44.77 94.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.536 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 257' ' ' HIS . . . . . 0.793 ' HB2' HD23 ' A' ' 300' ' ' LEU . 2.3 t-80 -55.96 -43.49 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.163 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -62.07 -40.97 97.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.19 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 259' ' ' HIS . . . . . 0.519 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 80.2 t60 -58.76 -48.21 82.02 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.413 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -63.52 -33.44 75.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.544 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -61.63 -47.71 84.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.214 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -61.43 -46.25 90.87 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.051 0.453 . . . . 0.0 110.061 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 263' ' ' GLN . . . . . 0.519 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.6 mp0 -64.7 -35.18 80.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.242 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.82 -42.59 99.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.06 -46.24 85.23 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.467 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.64 -43.37 98.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.346 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -63.26 -36.89 85.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.252 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -61.64 -47.73 84.05 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.332 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -64.54 -43.52 93.7 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.628 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.49 -43.09 99.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.518 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.573 HD23 ' O ' ' A' ' 271' ' ' LEU . 6.1 tt -60.85 -44.38 97.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.322 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.97 -43.9 91.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.281 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -69.07 -47.32 65.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.663 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.841 ' O ' HG22 ' A' ' 277' ' ' VAL . . . -60.43 -24.63 65.34 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.492 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -84.46 -1.74 56.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.476 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 42.2 m -120.06 -3.14 10.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.707 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.841 HG22 ' O ' ' A' ' 274' ' ' ALA . 16.8 m -63.33 -42.66 97.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.499 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.448 ' N ' HG23 ' A' ' 277' ' ' VAL . . . 139.03 -82.9 0.25 Allowed Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.88 139.06 58.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.757 0.313 . . . . 0.0 110.402 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -107.41 116.44 4.92 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -145.49 -45.12 0.21 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.488 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -98.7 0.64 45.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.553 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.97 -48.29 88.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.538 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.5 t -63.36 -46.84 84.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.907 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.6 -41.65 96.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.739 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.0 t -62.47 -44.07 97.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -63.43 -41.61 98.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.498 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -60.34 -52.33 65.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.278 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.534 ' HD3' HD23 ' A' ' 292' ' ' LEU . 18.2 mmtm -65.77 -33.42 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.135 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -56.45 -48.05 77.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.155 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.22 -40.44 71.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.968 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.591 ' O ' HD12 ' A' ' 292' ' ' LEU . 3.5 tp -61.81 -50.67 71.39 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.26 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 23.9 tp -63.63 -41.48 98.25 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.4 tt0 -62.73 -37.72 87.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.022 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 295' ' ' GLY . . . . . 0.463 ' O ' ' HG3' ' A' ' 299' ' ' GLU . . . -64.01 -47.03 89.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 296' ' ' ARG . . . . . 0.461 HH12 HD22 ' A' ' 300' ' ' LEU . 15.4 tpt85 -57.82 -44.16 86.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.474 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 12.2 p -60.36 -48.1 83.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.346 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 299' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 295' ' ' GLY . 90.3 mt-10 -57.95 -55.33 36.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.592 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 300' ' ' LEU . . . . . 0.793 HD23 ' HB2' ' A' ' 257' ' ' HIS . 12.9 tp -61.56 -45.03 95.87 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.465 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -47.43 -47.02 22.88 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.084 -1.206 . . . . 0.0 110.084 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -65.48 -37.15 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.929 0.395 . . . . 0.0 109.967 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 20.0 m -60.47 -47.4 86.29 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 304' ' ' VAL . . . . . 0.401 HG13 HD13 ' A' ' 308' ' ' LEU . 1.3 t -61.36 -46.13 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.376 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.41 -46.78 88.69 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.044 0.449 . . . . 0.0 110.284 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -58.56 -50.18 74.72 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.424 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.55 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.4 OUTLIER -65.07 -30.34 71.29 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.99 178.536 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.782 HD11 HG21 ' A' ' 223' ' ' VAL . 1.4 tp -58.53 -46.58 86.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.056 -178.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -76.15 -54.49 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.813 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 310' ' ' ASP . . . . . 0.415 ' C ' ' OD1' ' A' ' 310' ' ' ASP . 61.6 t0 -58.96 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.55 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 3.4 tp -61.67 -39.79 92.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.512 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 312' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 10.4 t -58.73 -43.56 90.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.665 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.17 -40.12 94.8 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 317' ' ' ARG . 77.5 mtp180 -61.7 -43.46 98.82 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-O 120.693 0.282 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.7 -42.48 95.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.792 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 83.6 p -49.67 -39.77 37.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.224 0.535 . . . . 0.0 109.649 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 314' ' ' ARG . 22.4 tpp85 -117.98 122.82 44.2 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.643 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -131.68 99.42 4.78 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.289 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -100.23 -167.8 1.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.736 -178.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 79.3 m80 -70.0 -168.86 0.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.81 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 58.77 42.36 20.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.511 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 50.31 25.06 1.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.661 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.542 ' C ' HD23 ' A' ' 323' ' ' LEU . 5.0 tt . . . . . 0 C--O 1.219 -0.502 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.378 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.8 p -88.54 -2.92 58.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.722 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 38.2 ptt-85 -62.89 137.04 58.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.726 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -170.58 116.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.536 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -165.02 99.66 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -161.51 171.25 18.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.688 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 54.84 92.6 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.378 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.61 142.91 95.8 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.398 2.065 . . . . 0.0 112.003 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 2.8 tmtm? -97.48 -42.65 0.25 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.62 ' CD ' ' N ' ' A' ' 9' ' ' LYS . 31.2 Cg_exo -61.57 146.62 96.77 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.751 2.301 . . . . 0.0 112.466 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.601 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER 171.33 -42.2 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.666 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 11' ' ' SER . 17.1 Cg_exo -64.28 151.5 85.19 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 C-N-CA 122.614 2.209 . . . . 0.0 111.913 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -66.51 153.11 43.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.378 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.7 ptm180 -63.01 137.25 58.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.598 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -137.43 151.18 48.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.2 p -138.87 152.72 48.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.568 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.38 178.51 25.39 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -166.68 121.33 1.1 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.858 0.361 . . . . 0.0 110.635 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -68.23 -34.78 76.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.651 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -124.57 167.26 14.72 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.787 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -88.68 2.39 53.37 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.723 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.436 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 3.7 mmt -143.11 140.06 30.71 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.375 0.607 . . . . 0.0 110.824 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.22 -36.26 81.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.306 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -56.5 -47.08 80.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.131 0.491 . . . . 0.0 110.542 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 25' ' ' LEU . 99.3 mt -61.47 -40.17 93.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.856 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.436 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.5 m-80 -63.94 -37.4 87.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.169 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -60.39 -48.66 80.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.297 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.429 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 4.0 mm? -61.23 -42.38 98.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.205 179.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.509 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 34.1 t-105 -62.18 -44.53 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.229 0.538 . . . . 0.0 110.387 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -57.03 -44.96 83.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.246 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.6 -42.82 97.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.424 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.27 -41.85 80.5 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.218 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.509 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.2 mt-30 -64.7 -37.67 88.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.192 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -60.09 -43.62 95.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.449 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.39 -39.46 92.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.596 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.45 110.72 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.849 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.47 HD22 ' HE ' ' A' ' 41' ' ' ARG . 13.8 mt -131.46 154.16 81.81 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.62 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -43.28 154.32 0.18 Allowed 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.618 2.212 . . . . 0.0 112.193 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.51 -42.04 69.74 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.582 2.188 . . . . 0.0 112.191 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.15 -49.71 82.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.551 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.47 ' HE ' HD22 ' A' ' 37' ' ' LEU . 78.6 mtp85 -66.47 -41.35 89.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 tp -64.26 -40.18 95.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.434 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 41' ' ' ARG . 18.1 pt-20 -65.15 -38.86 91.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.466 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.37 -50.11 72.85 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.398 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.3 t60 -61.2 -39.97 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.444 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.94 92.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.425 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -60.56 -50.17 74.61 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.366 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.04 -39.3 94.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.383 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -56.55 -46.91 80.43 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.215 0.531 . . . . 0.0 110.142 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.7 mt -62.31 -42.73 96.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.761 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -51.51 -42.81 61.98 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -64.42 -41.26 96.7 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -61.4 -44.45 97.13 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.629 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -61.22 -41.62 97.17 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.373 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -54.75 -46.74 74.37 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.149 0.499 . . . . 0.0 110.062 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 23.8 mt -61.72 -41.4 97.57 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.334 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.94 -46.33 88.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.647 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.5 t90 -58.99 -39.9 83.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.342 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -59.89 -46.06 90.53 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.08 -41.51 92.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.114 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.36 -40.5 94.51 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.956 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.37 -43.3 96.69 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 51.5 tp -59.65 -42.64 93.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.889 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -67.23 -35.53 79.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.253 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 94.55 26.62 13.04 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 81.8 mt -81.07 -42.37 21.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.834 0.349 . . . . 0.0 110.906 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' A' ' 68' ' ' ASP . 54.4 p-10 -67.49 147.72 52.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.377 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -161.82 -51.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.596 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.59 -29.37 69.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.473 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 85.46 9.71 78.52 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -56.94 -36.63 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.863 0.363 . . . . 0.0 110.32 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -58.86 -64.78 0.81 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.853 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -44.87 -42.73 8.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.209 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.11 84.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.214 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -62.04 -41.58 98.27 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.495 ' N ' HD12 ' A' ' 77' ' ' LEU . 10.7 mp -62.86 -43.65 98.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.957 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.36 -47.72 90.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.106 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.681 ' O ' HG23 ' A' ' 83' ' ' VAL . 93.7 mtt-85 -59.51 -43.35 93.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.924 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.501 ' O ' HG13 ' A' ' 84' ' ' ILE . 93.2 m-20 -64.33 -41.26 96.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.389 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.3 -48.33 71.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.008 0.432 . . . . 0.0 110.253 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -66.77 -36.48 82.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.366 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 79' ' ' ARG . 75.1 t -63.85 -47.95 88.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.539 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 80' ' ' ASN . 48.6 mt -61.26 -50.34 80.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.631 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.22 -41.79 94.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.918 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.68 80.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.72 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.29 -44.77 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.844 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -59.47 -34.27 72.35 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.098 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 88.79 17.76 55.86 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.888 ' O ' ' N ' ' A' ' 92' ' ' GLY . 5.4 mt -83.29 -83.32 0.14 Allowed 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.472 ' CG ' ' H ' ' A' ' 92' ' ' GLY . 3.1 p-10 43.7 -65.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.951 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.888 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . 139.78 -175.66 21.66 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -93.8 5.08 52.83 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.632 0.253 . . . . 0.0 110.636 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt 64.04 41.58 6.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.77 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 46.7 p-10 -147.35 137.88 23.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.676 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -169.47 -64.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.657 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 55.39 80.91 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.457 ' OE1' ' O ' ' A' ' 98' ' ' GLN . 4.0 pp0? -175.47 25.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.736 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 85.5 t -63.89 -44.26 97.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.435 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 42.8 p -65.75 -18.42 65.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.317 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.6 m -59.5 -40.9 88.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.53 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -107.77 -177.65 3.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.571 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.584 ' O ' ' O ' ' A' ' 104' ' ' LEU . 52.1 m 56.15 50.59 13.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.432 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.584 ' O ' ' O ' ' A' ' 103' ' ' SER . 10.8 mp 51.09 155.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.691 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 17.3 m -78.66 146.35 34.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.251 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -161.85 68.76 0.23 Allowed Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 41.1 m -72.18 127.52 32.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.796 0.331 . . . . 0.0 110.244 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.94 148.49 5.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.556 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -160.89 20.7 0.13 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -98.67 111.38 23.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.969 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.3 124.61 4.63 Favored Glycine 0 CA--C 1.521 0.439 0 N-CA-C 111.254 -0.738 . . . . 0.0 111.254 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.554 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 19.7 mt -58.82 146.29 37.73 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.664 0.269 . . . . 0.0 110.366 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -90.16 -5.18 56.73 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.551 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -79.97 124.69 82.96 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.43 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.414 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 37.6 Cg_endo -65.76 -34.38 40.59 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.378 2.052 . . . . 0.0 112.625 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 48.7 mmm-85 -68.12 -45.82 72.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.093 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 46.8 mt -74.24 -33.75 63.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.616 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.554 ' OE2' ' O ' ' A' ' 112' ' ' LEU . 68.0 mt-10 -58.5 -33.35 69.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.811 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.76 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 52.7 mtpt -61.09 -48.35 82.11 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.901 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.575 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 13.5 mt -70.57 -46.83 62.75 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.966 0.412 . . . . 0.0 111.939 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.673 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.8 t-105 -59.38 -49.54 77.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.456 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -71.16 -32.85 69.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.661 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.76 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 11.6 tptt -55.43 -51.65 66.19 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.949 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.09 -46.79 49.42 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.885 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.412 ' HB2' HD11 ' A' ' 135' ' ' LEU . 58.4 tttm -50.97 -48.75 61.03 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.969 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 12.4 m -83.91 -41.15 17.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.872 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.597 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 8.8 t -46.48 -26.1 0.8 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.296 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -159.09 -94.51 0.1 Allowed Glycine 0 N--CA 1.464 0.536 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.363 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.548 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.2 pttp -161.52 24.08 0.12 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.96 44.74 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.318 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.1 p -103.44 136.42 43.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.083 0.468 . . . . 0.0 111.288 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 97.89 -97.1 1.89 Allowed Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.173 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 94.7 mt-10 -75.11 -43.81 50.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.806 0.336 . . . . 0.0 111.116 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.62 ' O ' HD23 ' A' ' 138' ' ' LEU . 53.3 mp0 -61.82 -54.38 43.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.673 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.8 mt -59.63 -40.51 87.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.323 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -60.77 -44.11 97.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 61.3 mttp -60.55 -44.17 96.42 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.665 HD13 ' OE2' ' A' ' 141' ' ' GLU . 4.5 mm? -57.79 -39.11 76.76 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.607 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -73.28 -29.43 62.73 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.344 -0.843 . . . . 0.0 113.08 177.174 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.512 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 95.3 mtt-85 -57.38 -46.49 83.36 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.097 -1.041 . . . . 0.0 108.243 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.665 ' OE2' HD13 ' A' ' 138' ' ' LEU . 6.1 pt-20 -72.71 -37.65 67.73 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.733 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.607 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.9 m-85 -55.75 -57.26 12.76 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.393 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.787 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 48.6 mt -61.75 -39.22 90.84 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.043 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.512 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 63.4 m170 -54.54 -41.02 69.25 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.758 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -65.28 -45.88 82.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.193 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.787 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 45.4 pttt -59.65 -44.43 93.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.175 -178.116 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.545 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 74.1 mm-40 -68.24 -48.88 63.94 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.542 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -60.99 -44.21 97.74 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.856 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.84 -45.36 99.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.112 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.702 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.3 m170 -64.59 -34.29 77.91 Favored 'General case' 0 C--O 1.216 -0.699 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.362 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -64.65 -48.04 76.27 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.229 -0.589 . . . . 0.0 110.502 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.424 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 37.2 m-85 -63.95 -46.37 85.01 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.566 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -69.1 -45.18 70.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.837 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 150' ' ' HIS . 71.2 t -64.79 -43.73 96.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.342 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 37.6 mt -62.7 -50.53 70.76 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.373 -179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.77 ' C ' HD12 ' A' ' 156' ' ' LEU . 0.3 OUTLIER -66.18 -40.67 90.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.723 -179.358 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 157' ' ' GLU . . . . . 0.576 ' N ' ' HG ' ' A' ' 156' ' ' LEU . 74.2 mm-40 -70.8 -30.02 66.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.038 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' THR . . . . . 0.597 ' O ' ' OG1' ' A' ' 162' ' ' THR . 6.1 m -64.99 -51.01 64.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.73 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 160' ' ' SER . 2.3 pp -73.83 -37.72 64.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.662 ' N ' HD12 ' A' ' 159' ' ' LEU . 50.5 m -63.73 -43.71 95.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.255 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.471 ' CG ' ' N ' ' A' ' 162' ' ' THR . 8.9 ptm180 -73.16 -41.19 64.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.155 -179.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.63 ' C ' ' H ' ' A' ' 164' ' ' GLU . 14.6 p -80.04 164.6 23.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.722 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 59.24 -5.29 0.07 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.374 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.63 ' H ' ' C ' ' A' ' 162' ' ' THR . 93.0 mt-10 -146.38 24.98 1.24 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.354 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.525 ' O ' ' CG ' ' A' ' 166' ' ' HIS . 3.6 tp -55.88 132.82 19.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.378 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.525 ' CG ' ' O ' ' A' ' 165' ' ' ILE . 73.5 m80 -160.46 46.48 0.23 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.099 0.476 . . . . 0.0 109.779 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -51.11 85.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.881 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.523 ' N ' ' O ' ' A' ' 166' ' ' HIS . 89.9 m-20 -141.5 -164.9 1.87 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.47 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 18.4 m -65.99 134.06 30.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.941 0.401 . . . . 0.0 110.476 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 16.3 tt -69.65 153.92 8.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.519 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' SER . . . . . 0.564 ' O ' ' N ' ' A' ' 173' ' ' SER . 5.6 p -129.22 86.04 57.85 Favored Pre-proline 0 N--CA 1.456 -0.149 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.321 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -38.74 83.95 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 122.806 2.337 . . . . 0.0 112.146 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.564 ' N ' ' O ' ' A' ' 171' ' ' SER . 0.1 OUTLIER -108.09 116.13 31.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.632 -179.667 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -62.65 -45.64 91.9 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.329 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.512 ' O ' ' N ' ' A' ' 177' ' ' ASP . 2.6 mt -147.27 24.26 1.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.5 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.515 ' O ' ' OD1' ' A' ' 177' ' ' ASP . 4.3 m 43.93 17.79 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.451 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.515 ' OD1' ' O ' ' A' ' 176' ' ' SER . 3.8 p-10 45.0 44.81 8.43 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.624 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.643 HG22 ' H ' ' A' ' 181' ' ' SER . 2.7 mt -72.65 127.88 35.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.371 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -63.97 -42.06 97.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.593 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -90.05 -47.03 3.99 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.643 ' H ' HG22 ' A' ' 178' ' ' ILE . 1.2 m 58.01 20.52 6.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.606 0.241 . . . . 0.0 110.465 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.583 ' O ' HG12 ' A' ' 182' ' ' VAL . 50.2 t -54.13 -0.88 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.827 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 181' ' ' SER . 28.4 mt -80.49 -6.76 58.66 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.967 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.57 ' CD2' ' O ' ' A' ' 181' ' ' SER . 5.4 p80 -60.22 -37.4 80.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.377 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.548 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 72.5 m -61.85 -45.43 93.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.098 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.613 ' O ' HD13 ' A' ' 190' ' ' LEU . 77.6 mtp85 -63.81 -44.74 92.37 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.859 -0.337 . . . . 0.0 110.795 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -62.92 -38.68 91.97 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.984 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 58.8 m -61.27 -45.77 93.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.983 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -58.06 -42.76 86.19 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.7 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 186' ' ' ARG . 8.8 mp -61.78 -38.55 88.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.225 178.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 195' ' ' ARG . 97.9 mttt -67.67 -32.48 73.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.388 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 97.3 mt-10 -67.85 -50.12 58.33 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.023 0.44 . . . . 0.0 111.386 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.469 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 ptmt -71.55 -41.76 68.71 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.373 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.778 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.29 -41.72 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.841 -179.361 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.559 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 14.6 ptm180 -63.46 -39.13 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.7 -41.72 97.98 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 193' ' ' LYS . 85.2 mt -64.2 -43.32 97.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.561 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.475 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.5 m-20 -62.59 -40.86 98.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.247 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.524 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 1.3 mp0 -60.55 -39.17 86.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -62.94 -37.96 95.79 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 201' ' ' LEU . 21.6 mt -63.19 -41.12 99.15 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.717 178.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.543 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.5 OUTLIER -64.2 -35.97 82.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.482 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.5 tmt_? -64.25 -41.15 97.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.915 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.9 mt -61.58 -40.25 94.07 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -61.69 -42.86 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.897 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.577 ' O ' ' HG2' ' A' ' 210' ' ' GLN . 73.5 mtp85 -62.7 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.676 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -62.55 -36.6 75.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 75.4 p -77.37 -26.08 51.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.094 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -95.05 -12.98 25.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.884 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.577 ' HG2' ' O ' ' A' ' 206' ' ' ARG . 12.3 pt20 -131.82 -37.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.303 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.629 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -78.57 31.72 1.9 Allowed Glycine 0 CA--C 1.527 0.825 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.445 ' H ' ' C ' ' A' ' 210' ' ' GLN . 1.6 m-85 -59.17 -38.01 78.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.676 0.274 . . . . 0.0 111.289 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.453 ' O ' ' O ' ' A' ' 214' ' ' THR . 92.5 p -137.27 101.55 4.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.035 0.445 . . . . 0.0 110.359 -179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.844 HG22 ' H ' ' A' ' 215' ' ' GLU . 7.5 m 48.5 178.62 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.511 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.844 ' H ' HG22 ' A' ' 214' ' ' THR . 73.3 mm-40 -96.3 -42.2 8.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.379 -178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -102.58 128.38 49.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.547 -178.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.667 ' OE2' ' CD ' ' A' ' 220' ' ' GLU . 1.1 mm-40 -163.08 33.02 0.1 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.069 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -103.38 10.88 37.19 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.502 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -140.36 -25.58 0.78 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.237 -179.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.667 ' CD ' ' OE2' ' A' ' 217' ' ' GLU . 10.3 mt-10 -45.91 161.54 0.26 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.88 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -71.29 111.13 3.02 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.527 2.151 . . . . 0.0 112.45 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -170.32 -84.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.845 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.618 HG23 ' N ' ' A' ' 224' ' ' ILE . 2.7 m -61.87 -49.74 83.01 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 CA-C-O 121.506 0.67 . . . . 0.0 110.575 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.618 ' N ' HG23 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -67.25 -26.51 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -66.99 -42.48 84.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.417 0.627 . . . . 0.0 109.318 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.0 tp -61.08 -42.05 97.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.171 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.449 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 48.2 m0 -60.62 -37.76 82.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.848 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -60.7 -39.47 88.66 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 229' ' ' LEU . 92.8 mt -62.44 -42.25 99.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.947 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 227' ' ' TRP . . . -41.19 -32.44 0.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.855 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -68.95 -67.83 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.657 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 91.0 p -66.23 -18.87 65.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.495 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.25 -106.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.653 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -155.83 105.03 2.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.536 HD22 ' OE2' ' A' ' 239' ' ' GLU . 70.9 mt -146.68 168.59 20.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.715 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 69.4 p -80.12 164.43 23.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -63.39 -49.4 73.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.99 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.18 -44.84 94.29 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.566 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.536 ' OE2' HD22 ' A' ' 235' ' ' LEU . 81.6 tt0 -62.95 -36.18 82.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.027 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.749 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.33 -44.05 96.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.985 0.422 . . . . 0.0 110.44 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.64 -55.02 30.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.506 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.36 77.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.065 0.46 . . . . 0.0 110.402 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.418 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.04 -43.8 98.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.283 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -54.14 -54.21 42.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.045 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -62.54 -39.08 92.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.282 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -56.86 -51.96 67.01 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.233 0.54 . . . . 0.0 110.45 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.2 mm? -63.42 -36.86 85.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.772 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.439 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 88.7 tttt -55.94 -48.46 75.7 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.303 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 249' ' ' HIS . . . . . 0.405 ' O ' ' HD3' ' A' ' 253' ' ' LYS . 19.4 m-70 -66.64 -39.56 88.32 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 250' ' ' PHE . . . . . 0.457 ' CE2' HD11 ' A' ' 311' ' ' LEU . 3.1 m-85 -62.28 -48.96 77.6 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.005 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.6 pt-20 -61.47 -35.07 76.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.231 0.538 . . . . 0.0 109.644 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.05 83.06 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.282 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 253' ' ' LYS . . . . . 0.405 ' HD3' ' O ' ' A' ' 249' ' ' HIS . 1.9 mptm? -61.03 -46.59 90.09 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.725 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.505 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.5 tp -63.67 -37.09 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.218 -0.447 . . . . 0.0 109.891 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -56.61 -51.43 68.67 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.036 0.446 . . . . 0.0 109.87 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -61.99 -42.65 99.38 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -55.37 -44.31 75.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.199 0.523 . . . . 0.0 110.199 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -62.12 -40.15 94.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.024 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -57.8 -46.33 84.8 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.117 0.484 . . . . 0.0 110.514 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -63.69 -36.36 83.59 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -58.88 -48.33 81.8 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.03 -44.88 94.33 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -63.34 -37.54 87.68 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.082 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.74 -41.86 97.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.37 -48.13 82.66 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.39 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 63.6 mt -62.15 -42.82 96.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.333 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.65 -36.91 82.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.349 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -63.34 -46.41 86.69 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.091 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.28 -45.72 92.35 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.135 0.493 . . . . 0.0 110.604 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.66 -37.77 85.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.42 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.22 -43.8 98.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.23 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -61.33 -43.24 99.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.309 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 273' ' ' HIS . . . . . 0.44 ' O ' ' OG ' ' A' ' 276' ' ' SER . 78.2 m80 -69.49 -40.15 77.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.756 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.647 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.6 -38.3 89.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.4 -24.43 67.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.667 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 276' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 273' ' ' HIS . 78.7 p -78.59 -5.84 53.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.637 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 274' ' ' ALA . 10.6 p -60.1 -30.13 45.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.444 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 102.42 -72.04 0.32 Allowed Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -65.01 139.09 58.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.779 0.324 . . . . 0.0 110.544 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -92.01 126.77 8.64 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -166.11 -78.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.821 0.343 . . . . 0.0 110.482 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -72.75 -6.63 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 54.7 t -64.2 -45.17 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.533 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 1.1 p -62.2 -44.87 95.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.848 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -62.15 -44.28 96.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 t -60.86 -45.39 94.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.537 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -63.57 -35.29 80.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.417 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -60.8 -61.95 2.21 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.23 0.538 . . . . 0.0 110.363 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.555 ' HD3' HD23 ' A' ' 292' ' ' LEU . 11.4 mmtm -62.01 -35.4 78.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.116 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -51.27 -48.42 62.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.879 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.07 76.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.555 HD23 ' HD3' ' A' ' 289' ' ' LYS . 17.0 tp -62.06 -52.4 64.06 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.55 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 8.8 mp -63.47 -42.59 98.59 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.196 0.522 . . . . 0.0 110.097 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.592 ' O ' ' OG1' ' A' ' 297' ' ' THR . 83.2 tt0 -63.28 -36.37 83.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.817 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.21 -44.13 97.54 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 296' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 296' ' ' ARG . 16.5 tpp180 -60.12 -43.11 95.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.468 . . . . 0.0 110.176 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.592 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 19.9 p -58.34 -43.36 88.24 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -39.85 95.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.358 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -58.41 -49.2 78.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.329 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 300' ' ' LEU . . . . . 0.427 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.7 OUTLIER -60.35 -43.55 96.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.512 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.27 -42.57 82.87 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -63.65 -47.14 82.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.054 0.454 . . . . 0.0 110.655 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 303' ' ' THR . . . . . 0.429 HG22 ' ND1' ' A' ' 307' ' ' HIS . 10.8 m -61.5 -43.78 98.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.723 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.39 -41.82 88.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -60.19 -50.38 73.89 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-O 121.153 0.501 . . . . 0.0 110.535 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -63.04 -39.98 96.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.459 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.429 ' ND1' HG22 ' A' ' 303' ' ' THR . 3.4 m170 -66.69 -33.65 76.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.997 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.533 HD21 HG21 ' A' ' 223' ' ' VAL . 3.9 mt -61.81 -46.12 90.89 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.661 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -68.31 -41.89 80.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.52 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.07 -47.17 84.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.886 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.457 HD11 ' CE2' ' A' ' 250' ' ' PHE . 26.8 mt -62.05 -43.2 99.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.964 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 78.4 p -62.74 -36.63 83.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.511 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.27 -45.04 83.84 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.503 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.85 -43.0 97.44 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.029 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 315' ' ' ILE . 55.8 mt -86.55 -2.62 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.739 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 46.9 t -59.15 -44.3 92.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.299 0.571 . . . . 0.0 109.464 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.508 ' CG ' ' N ' ' A' ' 318' ' ' ALA . 10.5 ptp85 -106.83 -42.72 4.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.233 -0.894 . . . . 0.0 108.866 178.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.508 ' N ' ' CG ' ' A' ' 317' ' ' ARG . . . 53.82 102.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.466 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 52.6 mmm-85 -73.37 159.8 32.76 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.078 -1.419 . . . . 0.0 111.899 -178.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -96.12 23.98 6.04 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.356 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.525 ' O ' ' O ' ' A' ' 322' ' ' GLU . 82.2 m-20 -155.1 46.27 0.51 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.134 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 321' ' ' ASN . 79.9 tt0 52.86 154.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.805 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 1.5 mp . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.726 -179.491 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 50.2 p90 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.2 m -159.62 -124.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.506 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.4 mtm-85 57.47 -172.93 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.285 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -123.51 122.18 37.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.526 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -109.49 141.21 42.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.27 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -111.93 11.19 20.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.422 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 51.23 79.34 0.35 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.485 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.34 143.9 99.5 Favored 'Trans proline' 0 N--CA 1.497 1.71 0 C-N-CA 122.618 2.212 . . . . 0.0 112.217 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.76 161.56 29.82 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.65 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.433 ' O ' ' C ' ' A' ' 11' ' ' SER . 34.3 Cg_endo -65.03 -83.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 122.709 2.273 . . . . 0.0 112.255 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 10' ' ' PRO . 43.0 t 36.05 64.38 2.31 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.531 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.03 141.61 64.84 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.633 2.222 . . . . 0.0 111.997 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -175.29 85.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.516 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 15' ' ' GLU . 86.2 mtm180 -134.88 -29.47 1.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.564 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.491 ' O ' ' O ' ' A' ' 16' ' ' SER . 96.2 mt-10 56.59 116.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.68 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' O ' ' A' ' 15' ' ' GLU . 96.1 p 50.77 168.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.752 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 158.96 -170.32 35.36 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -129.01 143.68 50.95 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.823 0.344 . . . . 0.0 110.411 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.444 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 56.1 mp0 -68.39 -43.57 77.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.912 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -123.13 173.38 7.91 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.69 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.513 ' C ' ' SD ' ' A' ' 22' ' ' MET . 87.7 mtm180 -93.8 8.61 40.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.734 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.513 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -136.21 133.88 37.55 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.263 0.554 . . . . 0.0 110.711 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 58.4 mp0 -65.72 -35.91 82.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.594 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' O ' HD23 ' A' ' 28' ' ' LEU . 64.8 mttp -58.65 -49.38 77.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.102 0.477 . . . . 0.0 110.506 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.89 -34.85 78.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.756 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -66.36 -40.67 89.93 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.54 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -62.97 -45.97 89.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.596 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 24' ' ' LYS . 3.4 mm? -61.88 -41.55 98.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.562 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.645 ' CH2' HD11 ' A' ' 42' ' ' LEU . 55.6 t-105 -62.29 -45.94 91.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.12 0.486 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.62 -45.26 89.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.694 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.24 -41.65 97.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.478 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.34 -41.7 97.48 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.552 ' O ' ' ND1' ' A' ' 36' ' ' HIS . 99.2 mt-30 -61.89 -39.29 91.43 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.076 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.549 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 85.5 mmt-85 -64.47 -38.99 92.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.601 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.7 -39.18 93.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.752 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.572 ' C ' HD23 ' A' ' 37' ' ' LEU . 66.5 m-70 66.21 106.58 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.818 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.576 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -132.21 155.8 80.86 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.51 179.844 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.437 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 72.5 Cg_exo -42.31 153.38 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.545 2.163 . . . . 0.0 112.364 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 31.0 Cg_exo -59.3 -40.54 67.34 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.734 2.29 . . . . 0.0 112.23 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 79.1 t -62.07 -47.08 94.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.548 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttm-85 -65.8 -42.13 91.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.539 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.645 HD11 ' CH2' ' A' ' 29' ' ' TRP . 48.5 tp -63.6 -45.16 91.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.69 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.77 -46.68 86.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.55 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -66.63 -42.52 86.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.421 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.588 HD13 ' OH ' ' A' ' 88' ' ' TYR . 59.0 tp -63.53 -51.2 66.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.848 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -58.07 -41.96 84.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.481 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.563 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.84 -47.31 86.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.544 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -56.18 -47.36 78.46 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.458 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.426 HD13 ' O ' ' A' ' 45' ' ' LEU . 6.9 mp -59.63 -40.29 87.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.035 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -58.85 -38.36 78.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 47' ' ' ALA . 28.3 mm -63.66 -42.52 96.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.785 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -57.72 -47.2 83.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.542 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -59.8 -50.51 73.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.26 0.552 . . . . 0.0 110.227 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 54' ' ' ARG . 71.3 mmt-85 -62.03 -41.0 97.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.564 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.413 ' O ' ' OD1' ' A' ' 55' ' ' ASP . 66.5 t0 -62.7 -39.28 93.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.543 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -60.03 -47.69 84.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.989 0.423 . . . . 0.0 110.152 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.75 -41.24 97.42 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.366 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.39 98.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.47 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.553 ' NE1' ' OD2' ' A' ' 68' ' ' ASP . 86.5 t90 -60.77 -41.28 95.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.343 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -61.3 -46.93 88.25 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -62.62 -43.14 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.406 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.5 mt -62.18 -41.49 98.37 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.146 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.491 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 88.6 tttt -60.69 -42.05 96.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.93 -40.37 95.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -64.75 -35.98 82.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.985 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.67 58.19 0.9 Allowed Glycine 0 CA--C 1.523 0.571 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 88.6 mt -125.11 -32.38 3.0 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.685 0.279 . . . . 0.0 110.656 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.553 ' OD2' ' NE1' ' A' ' 59' ' ' TRP . 46.1 t0 -91.81 115.3 27.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.365 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -134.5 -36.37 0.87 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.459 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -65.47 -34.39 78.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.413 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.49 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 89.26 14.96 59.55 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 111.014 -0.835 . . . . 0.0 111.014 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -68.61 -34.87 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.761 0.315 . . . . 0.0 110.592 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -60.63 -60.74 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.967 0.413 . . . . 0.0 110.251 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 18.0 pt-20 -56.36 -42.09 77.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.135 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.564 ' HB1' HH12 ' A' ' 79' ' ' ARG . . . -60.25 -40.7 91.25 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.265 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -61.3 -40.83 95.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -63.5 -43.36 97.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.128 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.79 -48.73 86.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.745 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.564 HH12 ' HB1' ' A' ' 75' ' ' ALA . 94.8 mtm-85 -60.91 -40.41 93.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.086 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.449 ' O ' HG13 ' A' ' 84' ' ' ILE . 7.2 t-20 -63.41 -37.98 89.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.375 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.687 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.7 -47.53 84.21 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.189 0.519 . . . . 0.0 109.847 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.5 m-20 -65.45 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.616 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 79' ' ' ARG . 72.2 t -62.79 -45.54 98.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.356 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.65 -48.39 87.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.268 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.2 mm? -64.95 -41.03 95.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.965 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.23 98.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.655 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -62.54 -48.06 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.538 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.588 ' OH ' HD13 ' A' ' 45' ' ' LEU . 9.6 m-85 -69.07 -23.44 64.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.295 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.25 22.55 75.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.5 mt -87.94 5.76 39.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.776 0.322 . . . . 0.0 110.484 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 42.5 p-10 -80.13 4.45 17.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.353 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -49.53 162.55 0.7 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.7 ptpt -142.3 154.39 44.67 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.811 0.338 . . . . 0.0 110.709 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -171.78 46.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.609 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 49.1 96.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.866 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.56 -60.13 4.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.662 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -145.75 -37.45 0.26 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.698 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? 62.92 117.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.586 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.17 158.1 41.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.57 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.439 ' O ' ' C ' ' A' ' 101' ' ' SER . 13.5 p -110.23 -20.49 12.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.714 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.439 ' C ' ' O ' ' A' ' 100' ' ' THR . 9.2 m 36.49 59.83 0.95 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.613 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -105.35 11.83 32.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.627 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.7 m -74.31 -8.08 55.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.613 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 104' ' ' LEU . 10.5 mp -86.72 -171.89 3.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.341 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 52.6 m 58.89 105.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.626 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -130.69 89.82 0.29 Allowed Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.412 ' O ' ' N ' ' A' ' 109' ' ' GLU . 54.8 p -64.6 -32.8 74.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.791 0.329 . . . . 0.0 110.462 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -47.74 95.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.5 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 107' ' ' THR . 95.5 mt-10 -138.79 118.17 12.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.558 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.447 ' C ' ' H ' ' A' ' 112' ' ' LEU . 96.7 m-20 -126.95 -42.29 1.75 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.53 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 70.3 -43.0 0.54 Allowed Glycine 0 CA--C 1.524 0.622 0 N-CA-C 110.754 -0.938 . . . . 0.0 110.754 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.447 ' H ' ' C ' ' A' ' 110' ' ' ASP . 9.8 tp -166.09 -85.51 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.623 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.652 ' OD1' ' N ' ' A' ' 114' ' ' ASP . 9.6 p30 176.9 -79.3 0.0 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.56 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.652 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 1.5 m-20 -59.35 135.57 88.58 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.312 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.442 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 40.2 Cg_endo -68.47 -23.97 36.92 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.599 2.199 . . . . 0.0 111.911 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -70.11 -46.27 65.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.886 0.374 . . . . 0.0 110.9 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.449 ' N ' HD12 ' A' ' 117' ' ' LEU . 8.3 mp -72.3 -37.44 68.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.769 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 114' ' ' ASP . 97.9 mt-10 -58.95 -33.31 70.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.478 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 66.6 mttm -61.25 -48.1 82.99 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.639 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.474 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 35.5 mt -66.75 -44.16 82.2 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.773 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.539 ' CD2' HD22 ' A' ' 135' ' ' LEU . 6.8 t-105 -59.22 -50.3 74.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.483 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -67.8 -32.2 72.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.266 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 127' ' ' SER . 10.8 tptt -56.94 -51.45 69.12 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.82 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.4 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.82 -47.03 64.31 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.554 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -53.86 -50.23 66.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.482 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -73.95 -42.83 59.94 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 123' ' ' LYS . 80.0 p -44.38 -29.58 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.01 0.433 . . . . 0.0 109.917 -178.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -161.4 -96.74 0.11 Allowed Glycine 0 N--CA 1.463 0.44 0 C-N-CA 119.848 -1.168 . . . . 0.0 111.581 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.787 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -154.91 22.75 0.44 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.463 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.2 m-30 -56.36 49.13 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.644 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.787 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -105.82 121.14 43.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.215 -179.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 114.63 -97.08 0.8 Allowed Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.211 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -77.33 -43.93 31.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.784 0.326 . . . . 0.0 110.989 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.463 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 58.5 mp0 -61.64 -51.74 67.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.018 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.539 HD22 ' CD2' ' A' ' 121' ' ' TRP . 1.1 mt -62.14 -40.86 97.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.261 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.69 -43.31 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -60.53 -42.57 96.76 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-O 121.199 0.523 . . . . 0.0 110.138 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mt -58.32 -43.52 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -66.81 -35.24 79.62 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.934 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -54.05 -41.4 68.08 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.076 -1.049 . . . . 0.0 108.227 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.684 ' OE1' HD21 ' A' ' 204' ' ' LEU . 50.5 mt-10 -71.45 -41.73 69.08 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.753 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.474 ' HZ ' HD13 ' A' ' 120' ' ' LEU . 3.5 m-85 -59.39 -57.7 11.83 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.66 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.467 HD23 ' HD2' ' A' ' 146' ' ' LYS . 95.8 mt -60.16 -38.98 84.82 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.206 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -54.99 -46.14 75.1 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.028 -0.669 . . . . 0.0 109.54 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.466 ' CE1' HG23 ' A' ' 197' ' ' ILE . 6.7 m-70 -60.88 -40.01 91.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.681 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.467 ' HD2' HD23 ' A' ' 143' ' ' LEU . 68.1 mttm -60.88 -44.47 97.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.456 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -70.18 -46.4 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.388 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.37 -47.04 85.92 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.05 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 37.3 t -64.56 -41.74 93.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.71 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.747 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -58.17 -44.31 87.9 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.327 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.56 -40.03 95.94 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.98 -50.28 69.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.954 0.406 . . . . 0.0 110.575 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -72.2 -43.75 64.03 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 150' ' ' HIS . 78.9 t -60.3 -46.71 94.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.943 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.52 -42.5 95.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.708 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.735 HD21 HD21 ' A' ' 190' ' ' LEU . 31.5 mt -63.21 -43.75 97.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.63 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -65.84 -31.3 72.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.198 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 72.4 m -67.29 -49.09 65.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.952 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.588 ' O ' ' O ' ' A' ' 162' ' ' THR . 3.9 pp -79.56 -20.29 47.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.705 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.564 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 73.4 m -60.76 -44.94 96.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.622 -179.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -62.17 -50.07 73.3 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.12 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.697 ' C ' ' H ' ' A' ' 164' ' ' GLU . 8.0 p -95.99 173.14 7.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.524 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 61.98 -20.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.02 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.697 ' H ' ' C ' ' A' ' 162' ' ' THR . 4.4 tp10 -113.98 22.69 13.67 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.867 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 8.4 tp -58.37 136.07 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.507 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -136.8 91.17 2.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.576 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.416 ' O ' ' CD ' ' A' ' 167' ' ' GLU . 3.0 pp20? -157.24 24.96 0.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.663 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -174.64 3.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.74 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 4.1 m -126.08 132.74 70.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.826 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.699 HG23 ' O ' ' A' ' 170' ' ' ILE . 19.2 tt -174.57 108.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.656 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 1.3 p -145.53 154.86 53.15 Favored Pre-proline 0 N--CA 1.454 -0.231 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.342 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -72.5 84.0 1.23 Allowed 'Trans proline' 0 C--N 1.306 -1.681 0 C-N-CA 122.648 2.232 . . . . 0.0 112.05 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 4.0 m -133.55 148.64 51.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.7 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -68.86 -23.13 64.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.296 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.651 ' O ' ' N ' ' A' ' 177' ' ' ASP . 0.5 OUTLIER -178.66 70.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.246 179.809 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 1.6 m 58.43 -68.01 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.356 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.651 ' N ' ' O ' ' A' ' 175' ' ' LEU . 35.6 p-10 -173.19 122.54 0.38 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.628 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 178' ' ' ILE . 28.4 mm -96.03 25.57 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.739 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -66.52 -37.9 86.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.357 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 172.25 80.84 0.05 OUTLIER Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.685 ' C ' ' H ' ' A' ' 183' ' ' LEU . 49.1 p -127.92 112.89 15.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.959 0.409 . . . . 0.0 110.477 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.477 HG23 ' H ' ' A' ' 182' ' ' VAL . 2.3 t -58.95 10.56 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.151 0.501 . . . . 0.0 110.576 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.685 ' H ' ' C ' ' A' ' 181' ' ' SER . 50.2 tp -59.9 -40.38 88.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.533 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.627 ' ND1' ' N ' ' A' ' 185' ' ' SER . 14.8 p80 -47.44 -45.75 25.96 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.082 0.467 . . . . 0.0 110.406 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.627 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 45.9 t -59.85 -42.23 93.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.895 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -58.56 -44.42 89.71 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.713 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -62.89 -40.83 98.73 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.126 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.2 m -61.71 -43.48 98.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.934 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -61.27 -39.8 91.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.037 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.735 HD21 HD21 ' A' ' 156' ' ' LEU . 5.4 mt -62.91 -46.21 88.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -69.69 -42.14 74.51 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.281 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -68.83 -43.01 76.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.565 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.552 ' O ' ' OG ' ' A' ' 196' ' ' SER . 20.5 pttt -74.24 -44.15 54.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.508 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.743 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.36 -41.69 80.28 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.875 -179.629 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.535 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.1 ptm180 -66.24 -37.31 85.2 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.552 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 91.9 p -59.09 -40.0 83.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.466 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.8 mt -63.64 -43.57 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.251 178.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -63.37 -41.02 98.8 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.636 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.456 HE22 HH12 ' A' ' 195' ' ' ARG . 95.8 mt-30 -61.11 -40.45 93.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.456 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.09 -41.26 97.99 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 201' ' ' LEU . 19.7 mt -62.4 -41.09 98.4 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.059 179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.585 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.3 OUTLIER -63.27 -36.05 82.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.544 ' HA ' ' HE ' ' A' ' 206' ' ' ARG . 3.5 tmm_? -63.46 -42.61 98.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.538 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.684 HD21 ' OE1' ' A' ' 141' ' ' GLU . 40.6 mt -62.15 -40.08 94.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.293 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.523 ' O ' ' ND1' ' A' ' 209' ' ' HIS . 74.4 mtp85 -62.39 -42.67 99.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.086 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.754 ' O ' ' N ' ' A' ' 210' ' ' GLN . 85.2 mtm180 -64.72 -39.32 93.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.183 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.528 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 41.3 t -64.75 -44.32 96.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.105 0.479 . . . . 0.0 110.521 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.6 m -73.93 -26.7 60.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.484 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' HIS . . . . . 0.523 ' ND1' ' O ' ' A' ' 205' ' ' ARG . 57.0 m80 -100.57 -26.18 13.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.176 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.754 ' N ' ' O ' ' A' ' 206' ' ' ARG . 42.9 tp60 -119.7 -29.62 4.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.881 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.528 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . -77.48 39.44 1.71 Allowed Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -107.84 145.94 32.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.737 0.303 . . . . 0.0 110.639 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.523 ' O ' HG23 ' A' ' 214' ' ' THR . 36.5 t -64.51 139.17 58.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.602 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.523 HG23 ' O ' ' A' ' 213' ' ' SER . 23.3 p -157.22 79.83 0.9 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.454 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -174.93 43.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.743 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -172.87 152.02 2.34 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.644 ' O ' ' CD2' ' A' ' 218' ' ' PHE . 55.1 mp0 -136.31 -16.91 1.59 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.845 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.644 ' CD2' ' O ' ' A' ' 217' ' ' GLU . 2.3 m-85 176.38 -15.74 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.748 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.546 ' O ' ' C ' ' A' ' 220' ' ' GLU . 84.2 tt0 -66.3 -46.69 76.09 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.042 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.546 ' C ' ' O ' ' A' ' 219' ' ' GLU . 23.7 tt0 27.06 94.3 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.609 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -47.96 82.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.471 2.114 . . . . 0.0 112.132 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 220' ' ' GLU . 56.8 ttm-85 -162.24 -50.9 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.585 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.479 HG23 ' H ' ' A' ' 224' ' ' ILE . 0.0 OUTLIER -64.59 -71.96 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.607 0 CA-C-O 121.328 0.585 . . . . 0.0 110.832 -179.684 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.479 ' H ' HG23 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -60.01 -25.58 33.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.342 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.14 -43.97 85.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.35 0.595 . . . . 0.0 109.64 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.41 -41.97 97.98 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -61.71 -36.66 81.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.798 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.63 -37.45 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.214 0.531 . . . . 0.0 109.745 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.666 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.0 mt -64.39 -41.49 96.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.82 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 235' ' ' LEU . . . -58.54 10.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.868 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.795 ' O ' HD21 ' A' ' 240' ' ' LEU . 17.1 pt20 -76.78 -47.44 21.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.703 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.43 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 76.8 p -129.66 9.52 5.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.644 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 233' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 234' ' ' ASN . . . -56.58 -49.6 74.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.578 -179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 234' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 233' ' ' ALA . 29.7 t30 173.66 74.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.636 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.494 HD12 ' N ' ' A' ' 235' ' ' LEU . 0.7 OUTLIER -136.05 172.64 12.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 -179.6 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.436 HG21 ' O ' ' A' ' 320' ' ' HIS . 43.2 p -94.07 167.02 11.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.72 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -62.52 -48.38 79.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.064 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.95 -45.0 95.58 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.43 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -62.5 -34.9 77.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.634 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.795 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -63.14 -41.51 99.31 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.534 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -63.85 -51.42 64.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.69 98.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.1 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -64.04 -43.14 96.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.91 178.838 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -57.3 -51.19 70.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.358 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -66.51 -40.37 89.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.585 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -59.36 -51.04 71.65 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.402 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.414 ' HG ' ' CE2' ' A' ' 243' ' ' PHE . 4.3 mm? -64.29 -37.04 86.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.563 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.691 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 33.6 ttpt -56.46 -43.8 79.92 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.192 0.52 . . . . 0.0 110.184 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -69.58 -42.71 74.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.488 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 250' ' ' PHE . . . . . 0.524 ' CE2' HD11 ' A' ' 311' ' ' LEU . 3.1 m-85 -61.93 -48.74 79.05 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.21 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.691 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 2.5 pp20? -60.27 -38.33 83.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.134 0.492 . . . . 0.0 109.905 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 252' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 251' ' ' GLU . . . -66.64 -36.59 82.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.366 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.23 -47.61 83.67 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.174 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.457 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.7 OUTLIER -65.1 -41.91 93.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.592 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 255' ' ' GLU . . . . . 0.401 ' N ' HG23 ' A' ' 254' ' ' ILE . 49.6 tp10 -61.4 -46.73 88.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.319 0.58 . . . . 0.0 110.112 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.57 -41.72 98.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.332 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -55.02 -45.44 75.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.124 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -61.3 -42.94 99.5 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.15 0.5 . . . . 0.0 110.19 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.4 -41.18 96.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.166 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 260' ' ' TYR . . . . . 0.425 ' O ' ' N ' ' A' ' 264' ' ' LEU . 26.0 m-85 -63.65 -37.29 86.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.522 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 261' ' ' GLN . . . . . 0.481 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 35.3 mm-40 -60.3 -52.02 67.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.229 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.69 -45.31 94.66 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.081 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -67.37 -30.44 70.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.277 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 264' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' A' ' 260' ' ' TYR . 46.4 tp -63.52 -45.4 90.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.047 0.451 . . . . 0.0 110.308 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.37 -47.63 69.84 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.519 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 97.6 mt -62.42 -43.06 97.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.943 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.056 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -59.56 -46.94 87.43 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.08 0.466 . . . . 0.0 110.193 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -62.6 -43.82 97.85 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.278 0.561 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.08 -39.51 90.18 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.327 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.728 HD23 ' C ' ' A' ' 271' ' ' LEU . 7.4 tt -59.85 -43.83 94.44 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.3 ttt85 -58.45 -44.46 89.24 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.126 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -68.52 -40.2 80.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.567 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.619 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -57.24 -44.21 83.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.692 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 275' ' ' GLU . . . . . 0.587 ' OE2' HD21 ' A' ' 271' ' ' LEU . 92.2 mt-10 -61.66 -22.28 65.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.494 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.5 t -91.85 5.84 48.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.626 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.619 HG12 ' O ' ' A' ' 274' ' ' ALA . 14.5 p -62.44 -43.66 98.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.61 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.556 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 166.41 -111.83 0.47 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -61.53 -41.01 96.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.78 0.324 . . . . 0.0 110.563 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 280' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 281' ' ' GLU . . . 152.72 -111.69 0.5 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 281' ' ' GLU . . . . . 0.636 ' C ' ' H ' ' A' ' 283' ' ' VAL . 95.5 mt-10 58.9 152.66 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 282' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' A' ' 281' ' ' GLU . 96.8 mtt180 64.26 -19.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 283' ' ' VAL . . . . . 0.636 ' H ' ' C ' ' A' ' 281' ' ' GLU . 8.9 p -67.91 -47.42 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.696 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 284' ' ' SER . . . . . 0.596 ' N ' HG13 ' A' ' 283' ' ' VAL . 42.1 m -63.41 -44.94 93.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.941 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -65.73 -43.53 88.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.833 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 59.1 m -61.11 -44.98 96.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.794 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 287' ' ' ARG . . . . . 0.553 ' NH2' ' OE2' ' A' ' 275' ' ' GLU . 94.8 mtt-85 -66.03 -39.61 90.34 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.189 0.519 . . . . 0.0 111.045 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.97 -59.21 5.82 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.073 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.647 ' HD3' HD23 ' A' ' 292' ' ' LEU . 54.6 mmtt -63.41 -39.88 95.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.07 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -41.81 -57.78 2.24 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.382 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.37 80.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.717 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.647 HD23 ' HD3' ' A' ' 289' ' ' LYS . 35.6 tp -60.65 -49.87 75.77 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.499 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 293' ' ' LEU . . . . . 0.442 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.8 mp -64.93 -41.63 95.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.978 0.418 . . . . 0.0 110.06 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -58.93 -45.35 90.59 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.182 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.28 -43.83 98.54 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -62.72 -38.87 92.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.419 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.481 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 1.5 m -60.75 -51.71 68.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.395 0.617 . . . . 0.0 110.076 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -65.3 -44.95 86.27 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.246 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -58.39 -38.01 76.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.987 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 300' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 300' ' ' LEU . 0.2 OUTLIER -62.72 -42.82 99.85 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.66 -46.19 93.68 Favored Glycine 0 CA--C 1.53 1.009 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.62 -43.51 93.75 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 110.45 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.8 m -60.26 -41.64 93.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.128 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.83 -43.86 89.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -57.6 -55.11 39.07 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.244 0.545 . . . . 0.0 110.619 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -62.73 -38.47 90.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.425 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -63.35 -38.01 89.51 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.279 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 6.8 mt -62.02 -44.56 96.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.343 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -70.59 -43.2 69.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.704 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -63.34 -46.02 88.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.836 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 250' ' ' PHE . 23.9 mt -63.43 -42.11 98.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.92 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 67.8 m -58.97 -44.29 91.5 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.362 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -71.04 -36.64 64.35 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.588 ' O ' HD22 ' A' ' 323' ' ' LEU . 43.5 ttm180 -63.2 -43.89 96.91 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.732 0.301 . . . . 0.0 110.758 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.591 ' O ' ' N ' ' A' ' 317' ' ' ARG . 2.3 mt -81.29 -97.16 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.904 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 316' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 315' ' ' ILE . 0.4 OUTLIER 35.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.095 0.474 . . . . 0.0 110.444 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.613 ' HD3' ' HE ' ' A' ' 319' ' ' ARG . 17.6 ptp180 -70.33 -36.95 74.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.465 -178.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.508 ' N ' ' O ' ' A' ' 315' ' ' ILE . . . 50.83 91.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.613 ' HE ' ' HD3' ' A' ' 317' ' ' ARG . 18.0 mmt85 -69.98 160.99 30.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.982 -178.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 320' ' ' HIS . . . . . 0.463 ' CG ' ' N ' ' A' ' 321' ' ' ASN . 47.0 p-80 -56.44 -42.88 78.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.417 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.463 ' N ' ' CG ' ' A' ' 320' ' ' HIS . 95.9 m-20 -96.64 148.96 22.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.768 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -48.37 128.35 14.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.25 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.588 HD22 ' O ' ' A' ' 314' ' ' ARG . 2.7 mp . . . . . 0 C--O 1.219 -0.511 0 CA-C-O 118.088 -0.958 . . . . 0.0 110.636 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.5 m -72.38 146.93 46.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.307 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.486 ' O ' ' O ' ' A' ' 4' ' ' GLU . 56.7 ttt180 -129.49 99.15 5.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.36 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 3' ' ' ARG . 83.2 tt0 33.47 97.15 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.121 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -66.79 131.46 45.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.469 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -135.71 -89.82 0.31 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.535 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -150.87 153.32 33.24 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.373 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.14 156.22 29.79 Favored 'Trans proline' 0 N--CA 1.498 1.742 0 C-N-CA 123.063 2.509 . . . . 0.0 112.595 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.691 ' H ' ' HD2' ' A' ' 10' ' ' PRO . 3.7 tmtt? -156.75 -50.99 0.01 OUTLIER Pre-proline 0 N--CA 1.469 0.51 0 CA-C-N 116.746 -0.207 . . . . 0.0 111.46 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.691 ' HD2' ' H ' ' A' ' 9' ' ' LYS . 41.9 Cg_endo -77.18 114.81 3.85 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 121.914 1.742 . . . . 0.0 112.267 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.465 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 3.5 m 178.52 51.44 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.562 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.465 ' CD ' ' N ' ' A' ' 11' ' ' SER . 38.9 Cg_endo -65.53 144.16 78.11 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.589 2.193 . . . . 0.0 111.834 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -111.84 87.76 2.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.093 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -87.4 126.53 34.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.244 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -109.97 -6.94 15.04 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.958 0.409 . . . . 0.0 110.44 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 87.0 p -75.23 161.15 29.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.63 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -145.7 -174.29 17.74 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -137.14 174.5 10.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.69 0.281 . . . . 0.0 110.415 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -65.26 -35.19 80.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.852 0.358 . . . . 0.0 110.531 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.435 ' CD1' HD23 ' A' ' 25' ' ' LEU . 67.0 m-85 -133.83 158.77 42.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.892 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 21' ' ' ARG . 68.3 mtt180 -94.4 16.45 15.14 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.901 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.581 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.5 mmt -142.29 133.9 26.75 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.113 0.482 . . . . 0.0 111.217 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -67.3 -43.99 80.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.539 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -60.01 -45.69 91.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.419 0.628 . . . . 0.0 110.5 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.435 HD23 ' CD1' ' A' ' 20' ' ' PHE . 5.3 tp -60.76 -38.77 86.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.402 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.581 ' ND2' ' O ' ' A' ' 22' ' ' MET . 49.6 m-80 -62.37 -39.29 92.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.814 179.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -57.59 -46.25 84.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.258 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -61.42 -43.2 99.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.095 0.474 . . . . 0.0 110.41 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.404 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 24.8 t-105 -60.91 -45.41 94.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.235 0.54 . . . . 0.0 110.595 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.41 -40.61 87.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.264 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.402 ' HG2' ' NH2' ' A' ' 34' ' ' ARG . 67.3 mttm -60.57 -43.3 97.44 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.255 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.99 97.17 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.284 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.404 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.3 mt-30 -58.16 -45.07 88.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.344 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.531 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 93.7 mtm-85 -65.65 -33.98 77.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.48 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.459 HD12 ' HA ' ' A' ' 35' ' ' LEU . 14.3 tp -62.09 -37.57 85.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.127 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.531 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 54.4 m-70 65.94 109.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 mt -139.3 154.96 72.4 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.02 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 154.6 0.1 OUTLIER 'Trans proline' 0 C--N 1.312 -1.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.26 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.14 -34.7 16.02 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.461 2.108 . . . . 0.0 112.321 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.49 -48.91 81.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.617 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -69.94 -39.97 75.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.586 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.7 -43.89 95.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.586 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.09 -44.4 84.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.612 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -66.88 -45.73 77.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.643 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.405 HD22 ' OH ' ' A' ' 88' ' ' TYR . 57.1 tp -62.67 -47.91 81.61 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.534 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 54.0 t60 -59.03 -40.71 85.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.973 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.93 -45.13 93.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.812 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.07 -46.4 85.5 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.915 0.388 . . . . 0.0 110.409 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 40.6 mt -60.01 -40.84 90.65 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.128 0.489 . . . . 0.0 110.158 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -59.0 -39.64 82.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.059 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.4 mm -62.13 -43.8 98.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.648 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -55.74 -44.83 77.95 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.389 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -60.41 -46.73 88.94 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.261 0.553 . . . . 0.0 110.425 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.62 -43.34 93.84 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.7 -38.64 85.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.115 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -58.07 -47.32 83.52 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 16.0 mt -60.84 -42.6 98.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.391 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.09 99.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.5 t90 -57.6 -43.14 84.46 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.135 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.66 -45.87 92.19 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.03 0.443 . . . . 0.0 109.931 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.09 -44.45 91.91 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.431 ' CD2' ' NZ ' ' A' ' 73' ' ' LYS . 7.2 mp -62.72 -39.04 92.82 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.848 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.51 -44.55 76.73 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 30.6 mt -62.2 -41.38 98.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.038 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.61 -37.45 86.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.37 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.12 33.04 5.61 Favored Glycine 0 CA--C 1.528 0.87 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.6 mt -89.04 -56.53 3.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.84 0.352 . . . . 0.0 110.786 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 68' ' ' ASP . 10.0 p-10 -75.88 145.06 40.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -143.98 -50.74 0.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.454 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.89 -33.28 75.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.224 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.56 21.86 39.02 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -60.46 -33.97 73.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.431 ' NZ ' ' CD2' ' A' ' 62' ' ' LEU . 98.4 mttt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.042 0.449 . . . . 0.0 110.096 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -58.07 -42.88 86.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.147 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.51 92.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.371 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.407 ' HA ' ' HE ' ' A' ' 79' ' ' ARG . 61.3 ttp180 -60.37 -42.73 96.42 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.62 -42.83 99.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.7 -45.52 97.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.626 ' O ' HG23 ' A' ' 83' ' ' VAL . 88.8 mtm180 -61.58 -41.73 97.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.205 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -63.9 -38.94 92.95 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.294 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.741 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.9 tm? -59.54 -48.52 81.32 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.755 -0.778 . . . . 0.0 109.841 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -63.6 -38.67 92.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.639 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 79' ' ' ARG . 78.2 t -62.81 -46.42 96.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.346 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.32 -48.89 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.52 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.434 HD12 ' H ' ' A' ' 91' ' ' ASP . 4.0 mm? -65.49 -40.8 93.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.4 . . . . 0.0 110.897 178.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.85 -47.74 83.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.68 -44.13 97.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.104 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.405 ' OH ' HD22 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -63.43 -34.69 78.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.106 0.479 . . . . 0.0 109.954 179.739 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.46 25.9 55.76 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.822 ' O ' ' N ' ' A' ' 92' ' ' GLY . 45.9 mt -86.24 -83.29 0.18 Allowed 'General case' 0 C--O 1.231 0.107 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.513 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.434 ' H ' HD12 ' A' ' 85' ' ' LEU . 32.2 t70 53.54 -53.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.807 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.822 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . 107.62 -2.71 34.28 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 44.4 tptt -66.07 133.6 51.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.79 0.329 . . . . 0.0 110.35 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.451 ' O ' ' O ' ' A' ' 95' ' ' ASP . 54.9 tptt -58.18 -76.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.495 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 96' ' ' ALA . 42.8 t0 44.94 -173.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.359 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.518 ' N ' ' OD1' ' A' ' 95' ' ' ASP . . . -152.23 151.33 30.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.739 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.546 ' O ' ' O ' ' A' ' 98' ' ' GLN . 90.5 mtm-85 -142.33 112.81 7.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.519 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.546 ' O ' ' O ' ' A' ' 97' ' ' ARG . 48.1 tt0 53.16 122.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.502 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 59.5 t -108.77 131.95 58.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.29 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.6 p -65.63 153.55 41.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.293 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.6 m -59.38 -41.98 90.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.505 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -151.56 -85.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.555 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.6 p -163.11 1.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.768 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.4 ' N ' HD23 ' A' ' 104' ' ' LEU . 0.2 OUTLIER -112.95 124.15 51.97 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.738 0.304 . . . . 0.0 110.467 179.689 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 86.6 p -159.0 161.94 36.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.579 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.433 ' O ' ' N ' ' A' ' 108' ' ' GLN . . . 55.33 -95.06 0.03 OUTLIER Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.8 m 67.67 -59.9 0.4 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.721 0.296 . . . . 0.0 110.818 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.433 ' N ' ' O ' ' A' ' 106' ' ' GLY . 13.6 pt20 -146.8 145.5 29.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.546 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -145.56 112.95 6.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.444 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -134.1 -85.11 0.43 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.492 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.43 -104.3 0.19 Allowed Glycine 0 CA--C 1.52 0.345 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.7 tp -134.94 -85.92 0.39 Allowed 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 121.005 -0.278 . . . . 0.0 110.929 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.3 t0 174.81 -83.04 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.531 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -52.07 113.65 4.48 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.548 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -51.19 -35.6 52.94 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.325 2.017 . . . . 0.0 112.323 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 95.5 mtm-85 -61.17 -45.01 96.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.915 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.09 -39.46 82.88 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.408 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.475 ' HB3' ' CE1' ' A' ' 122' ' ' HIS . 99.1 mt-10 -54.84 -24.65 24.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.259 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 57.0 mtpt -60.15 -49.72 76.53 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.096 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.87 -44.75 69.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.975 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.69 ' CE2' HD13 ' A' ' 135' ' ' LEU . 9.2 t-105 -59.07 -48.84 80.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.49 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 118' ' ' GLU . 3.9 m80 -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.435 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.2 OUTLIER -55.91 -51.28 68.16 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.729 -178.812 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.29 -46.7 63.76 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.814 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -51.68 -51.53 55.18 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.648 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -76.68 -41.99 43.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.821 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.9 t -45.55 -27.34 0.73 Allowed 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.062 0.458 . . . . 0.0 109.912 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.12 -91.79 0.08 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.426 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.541 ' O ' ' N ' ' A' ' 131' ' ' SER . 11.8 ptmt -165.62 31.03 0.05 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.413 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -65.13 43.4 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.341 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.541 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -98.36 123.54 42.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.651 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 112.7 -97.29 0.88 Allowed Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.076 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -78.61 -43.24 26.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.749 0.309 . . . . 0.0 111.246 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 77.3 mm-40 -60.97 -51.97 66.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 0.0 110.142 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.69 HD13 ' CE2' ' A' ' 121' ' ' TRP . 2.2 mt -62.43 -42.89 99.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.035 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.21 -39.95 92.15 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 2.9 mmpt? -61.49 -42.1 98.28 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.281 0.562 . . . . 0.0 109.869 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mt -58.05 -43.39 86.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -36.15 82.74 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 176.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.507 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 6.5 mpt_? -54.12 -42.95 70.03 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.522 ' OE1' ' O ' ' A' ' 137' ' ' LYS . 5.6 mp0 -70.09 -41.86 73.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.825 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -61.06 -53.73 53.52 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.693 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 98.9 mt -59.92 -40.71 89.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.097 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' A' ' 140' ' ' ARG . 6.4 m80 -56.48 -44.28 80.48 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.478 ' O ' HG12 ' A' ' 149' ' ' VAL . 9.5 m-70 -63.28 -38.68 92.11 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.592 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -60.82 -43.14 98.6 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.106 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.531 ' HA ' ' CE1' ' A' ' 150' ' ' HIS . 98.1 mt-10 -69.83 -45.71 67.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.002 0.429 . . . . 0.0 111.684 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -70.65 -44.53 66.9 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.481 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.6 HG13 ' N ' ' A' ' 150' ' ' HIS . 4.4 p -63.44 -49.34 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.983 -178.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.783 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -70.51 -23.25 62.62 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.004 -179.39 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.613 ' HG3' ' CE1' ' A' ' 150' ' ' HIS . 24.6 mt-10 -67.18 -52.28 43.3 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.814 179.091 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -63.25 -41.53 99.07 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -63.92 -40.1 95.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.231 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 150' ' ' HIS . 19.8 t -60.38 -47.65 91.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.042 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.44 -43.76 93.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.844 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.547 HD21 HD21 ' A' ' 190' ' ' LEU . 19.7 mt -63.31 -42.3 99.01 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.647 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -65.07 -33.88 77.08 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.089 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 63.9 m -64.43 -49.95 69.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.823 -179.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 1.8 pp -78.87 -21.4 47.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.638 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.508 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 37.0 m -61.62 -32.33 72.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.869 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -53.0 -42.73 65.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.721 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.57 24.78 0.45 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.494 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -117.1 -27.6 6.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.994 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -103.17 61.49 0.78 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.941 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.714 ' O ' HG23 ' A' ' 165' ' ' ILE . 1.4 tt -134.46 103.67 4.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.483 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 29.3 m170 44.63 32.03 0.71 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.114 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 51.4 tp10 -93.09 116.8 29.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.592 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 45.7 p30 -158.92 18.64 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.54 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 1.5 m -123.47 129.27 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.602 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.6 tt -158.92 147.51 7.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.665 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -135.53 164.43 43.6 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.453 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.39 -30.94 65.73 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.814 2.342 . . . . 0.0 112.061 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.535 ' O ' ' N ' ' A' ' 175' ' ' LEU . 8.4 m -55.18 -14.79 1.83 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.678 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 13.5 t70 65.54 -41.9 0.34 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.579 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' A' ' 173' ' ' SER . 6.4 tp -162.72 46.95 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.427 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.507 ' O ' ' O ' ' A' ' 177' ' ' ASP . 12.8 t 49.07 67.12 0.93 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.479 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.507 ' O ' ' O ' ' A' ' 176' ' ' SER . 65.7 t0 56.05 124.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.806 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.426 HD11 ' HB3' ' A' ' 175' ' ' LEU . 96.3 mt -121.03 130.38 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.175 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.622 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -128.96 12.3 6.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.582 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 136.14 93.71 0.39 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.674 ' C ' ' H ' ' A' ' 183' ' ' LEU . 82.7 p -121.68 15.04 11.02 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.548 0.213 . . . . 0.0 110.604 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.469 ' O ' HG12 ' A' ' 182' ' ' VAL . 20.4 t 55.76 -7.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.751 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.674 ' H ' ' C ' ' A' ' 181' ' ' SER . 14.2 tp -62.34 -41.12 98.33 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.282 0.563 . . . . 0.0 110.687 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.418 ' CD2' ' H ' ' A' ' 184' ' ' HIS . 2.6 p80 -48.02 -34.23 9.11 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.309 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 47.0 t -60.27 -45.2 94.13 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.14 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.648 HH21 ' CD1' ' A' ' 183' ' ' LEU . 59.3 mtm180 -65.68 -39.42 91.29 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.544 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -66.3 -41.79 89.23 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.61 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 59.6 m -62.51 -44.61 95.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.325 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -63.48 -39.46 94.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.052 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.547 HD21 HD21 ' A' ' 156' ' ' LEU . 5.3 mt -62.3 -46.68 87.69 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.556 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.442 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.8 mttt -68.6 -38.27 80.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.942 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 85.4 tt0 -67.81 -48.21 66.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.764 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 14.3 pttt -73.2 -41.18 64.09 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.011 -179.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.705 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.52 -41.77 72.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.849 -179.4 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.523 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 12.8 ptm180 -65.72 -38.99 90.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.0 -42.29 98.16 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 193' ' ' LYS . 82.2 mt -64.42 -43.86 97.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.761 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -62.09 -41.7 98.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.504 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.29 -31.94 73.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.338 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.57 78.41 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 201' ' ' LEU . 24.8 mt -63.22 -40.8 98.5 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.864 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.56 -39.96 93.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -41.76 99.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.497 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.449 HD12 HD23 ' A' ' 201' ' ' LEU . 31.9 mt -60.9 -40.66 93.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.449 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -62.2 -44.24 97.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.294 0.569 . . . . 0.0 109.668 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.547 ' O ' ' N ' ' A' ' 210' ' ' GLN . 24.2 mmt85 -63.73 -39.54 94.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.069 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 211' ' ' GLY . 48.5 t -62.99 -45.64 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.042 0.449 . . . . 0.0 109.897 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 15.6 m -63.39 -29.51 70.8 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.339 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.9 m170 -93.57 -46.03 7.47 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.69 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.641 ' C ' ' H ' ' A' ' 212' ' ' TYR . 2.9 pp0? -105.56 -25.57 12.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.657 0.265 . . . . 0.0 111.112 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -61.42 8.17 0.12 Allowed Glycine 0 N--CA 1.459 0.202 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.641 ' H ' ' C ' ' A' ' 210' ' ' GLN . 65.2 t80 -66.98 166.94 12.64 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.186 0.517 . . . . 0.0 111.441 -179.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.6 ' N ' ' CG ' ' A' ' 212' ' ' TYR . 16.8 p -43.31 104.13 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.201 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 1.9 p -131.86 166.47 21.52 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.37 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -91.75 164.85 13.56 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.077 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 216' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 217' ' ' GLU . . . 65.1 -175.0 0.18 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.679 0.276 . . . . 0.0 110.846 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.454 ' HB3' ' O ' ' A' ' 216' ' ' ALA . 67.3 tt0 81.34 35.54 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -114.41 104.27 11.89 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -139.6 -34.61 0.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.329 -0.949 . . . . 0.0 112.698 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.97 151.24 86.31 Favored Pre-proline 0 C--O 1.235 0.325 0 C-N-CA 119.136 -1.025 . . . . 0.0 108.314 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.616 ' O ' ' N ' ' A' ' 223' ' ' VAL . 78.0 Cg_exo -38.26 -79.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.28 1.987 . . . . 0.0 112.418 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.413 ' H ' ' HB2' ' A' ' 221' ' ' PRO . 43.6 ttm180 36.09 -84.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.092 0.472 . . . . 0.0 111.402 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.817 HG11 HD21 ' A' ' 308' ' ' LEU . 2.1 t -59.75 -65.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.139 0.495 . . . . 0.0 110.691 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.414 HD11 ' HE1' ' A' ' 250' ' ' PHE . 1.1 mp -51.19 -28.03 6.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.754 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 225' ' ' ASP . . . . . 0.409 ' HB3' ' O ' ' A' ' 222' ' ' ARG . 56.6 t0 -63.51 -45.91 88.47 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 109.868 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.1 mt -61.2 -42.13 98.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.596 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.452 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 44.2 m0 -61.49 -36.67 81.12 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.355 -0.538 . . . . 0.0 109.949 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.8 -40.21 94.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 231' ' ' GLN . 96.8 mt -64.02 -41.81 97.33 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.263 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 227' ' ' TRP . . . -36.68 -29.39 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.999 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 229' ' ' LEU . 89.1 mt-30 -62.49 -65.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.715 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 5.4 t -87.05 14.69 7.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.688 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -80.47 -76.1 0.24 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.805 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -173.26 81.66 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.905 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 76.5 mt -141.54 149.26 40.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.615 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 240' ' ' LEU . 70.4 p -71.3 -167.01 0.2 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.407 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 237' ' ' ASP . . . . . 0.472 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 27.0 p-10 -82.53 -47.82 11.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.327 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 238' ' ' LYS . . . . . 0.401 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 65.1 mttp -63.38 -44.33 95.03 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.081 0.467 . . . . 0.0 110.625 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 322' ' ' GLU . 93.7 mt-10 -62.3 -36.45 82.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.686 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.758 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.2 -45.0 93.73 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.535 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -62.08 -46.73 87.81 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.465 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -63.24 -40.85 98.6 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.06 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.526 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -65.71 -43.73 88.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.52 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 244' ' ' ARG . . . . . 0.401 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 0.0 OUTLIER -59.99 -48.21 82.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.009 0.433 . . . . 0.0 110.441 -178.703 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -65.19 -46.08 82.2 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.825 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -57.27 -50.17 73.76 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.071 0.462 . . . . 0.0 110.345 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.97 -37.39 87.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.687 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.4 tttt -55.28 -47.63 75.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.061 0.458 . . . . 0.0 109.866 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -67.48 -43.77 80.16 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.076 -0.649 . . . . 0.0 110.989 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 250' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 29.9 t80 -60.65 -48.06 83.46 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.509 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.9 OUTLIER -61.86 -36.63 81.81 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.04 -41.6 90.66 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.826 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.45 -46.9 86.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 111.137 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -38.81 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.791 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -55.83 -48.8 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.343 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -62.24 -43.11 99.57 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.26 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -57.83 -43.1 85.6 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.131 0.491 . . . . 0.0 110.291 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -61.52 -40.97 96.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.364 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -59.18 -46.69 87.74 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 120.954 0.407 . . . . 0.0 110.285 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 260' ' ' TYR . . . . . 0.56 ' CD2' HD11 ' A' ' 293' ' ' LEU . 3.3 m-85 -62.07 -37.5 85.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.28 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -61.6 -42.62 99.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.524 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 24.1 mmtp -62.0 -45.64 92.74 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.098 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -66.34 -35.99 81.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.148 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.31 -43.73 98.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.39 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.46 -45.38 83.98 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.677 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 55.9 mt -62.97 -43.27 98.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.734 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.14 -38.63 83.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.035 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.29 -47.42 86.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.407 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -58.43 -48.85 79.37 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.361 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -61.11 -37.66 83.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.729 HD23 ' O ' ' A' ' 271' ' ' LEU . 4.7 tt -59.81 -44.26 94.07 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 -179.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -61.35 -44.81 96.55 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.078 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.49 -44.6 82.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.863 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.03 -34.69 73.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -59.92 -35.16 74.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.962 0.411 . . . . 0.0 110.116 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 15.6 m -61.25 -31.47 71.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.834 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.34 -44.04 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.453 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 105.03 6.1 40.12 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 279' ' ' ASP . . . . . 0.433 ' O ' HG23 ' A' ' 283' ' ' VAL . 48.9 t0 -84.35 100.47 11.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.379 . . . . 0.0 110.127 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.3 86.87 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -55.58 -50.8 69.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.582 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -66.53 -38.28 86.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.93 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 283' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 279' ' ' ASP . 72.5 t -60.87 -47.29 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.48 -46.4 88.65 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.054 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -62.44 -43.03 99.81 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.706 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.2 t -60.47 -45.14 94.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.459 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -64.07 -36.65 84.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.708 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.61 -58.87 6.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.551 ' HD3' HD23 ' A' ' 292' ' ' LEU . 28.5 mmtt -64.34 -33.48 75.94 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.061 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -55.26 -48.67 73.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.443 -0.503 . . . . 0.0 109.919 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.84 -39.1 80.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.964 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.551 HD23 ' HD3' ' A' ' 289' ' ' LYS . 8.5 tp -62.28 -54.92 33.71 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.736 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 293' ' ' LEU . . . . . 0.56 HD11 ' CD2' ' A' ' 260' ' ' TYR . 9.8 tp -62.65 -42.43 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.181 0.515 . . . . 0.0 109.958 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.484 ' O ' ' OG1' ' A' ' 297' ' ' THR . 81.7 tt0 -63.35 -36.98 85.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.993 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.47 -45.71 94.21 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -60.56 -44.03 96.63 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.056 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 21.9 p -59.39 -39.84 84.66 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.563 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.77 -47.47 83.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.029 0.442 . . . . 0.0 110.838 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.2 -41.29 92.67 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.092 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 300' ' ' LEU . . . . . 0.43 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.1 OUTLIER -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.953 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.44 -40.0 91.47 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -61.54 -46.7 88.82 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 110.486 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 17.7 m -60.34 -45.21 94.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.542 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.98 -42.18 91.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.854 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -56.59 -48.75 76.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.752 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -61.56 -42.89 99.5 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.185 0.517 . . . . 0.0 110.457 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -68.95 -31.09 69.71 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.311 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.817 HD21 HG11 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -61.94 -49.01 77.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.327 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 309' ' ' GLN . . . . . 0.421 ' HG3' ' N ' ' A' ' 310' ' ' ASP . 12.5 pt20 -67.88 -42.0 81.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 310' ' ' ASP . . . . . 0.444 ' OD1' ' NE ' ' A' ' 314' ' ' ARG . 48.4 t0 -62.29 -51.1 69.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.995 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.45 -40.19 95.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.883 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 66.5 m -58.58 -44.79 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.64 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -70.13 -45.47 55.98 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.462 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.444 ' NE ' ' OD1' ' A' ' 310' ' ' ASP . 95.1 mtt-85 -63.44 -47.52 81.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.724 0.297 . . . . 0.0 111.23 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -65.59 -43.19 94.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.643 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.0 p -58.51 -38.08 76.94 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.508 -0.477 . . . . 0.0 109.932 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.642 ' HG3' ' H ' ' A' ' 319' ' ' ARG . 43.2 tpt85 -86.38 -50.25 7.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.775 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.651 ' HA ' HD11 ' A' ' 323' ' ' LEU . . . 52.09 6.69 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -178.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.642 ' H ' ' HG3' ' A' ' 317' ' ' ARG . 96.0 mtm-85 24.76 -104.85 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.391 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -163.72 -52.11 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.264 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.649 ' O ' ' O ' ' A' ' 322' ' ' GLU . 35.2 t30 -90.81 86.75 6.41 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.373 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.649 ' O ' ' O ' ' A' ' 321' ' ' ASN . 0.9 OUTLIER 39.1 178.33 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.376 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.651 HD11 ' HA ' ' A' ' 318' ' ' ALA . 81.8 mt . . . . . 0 C--O 1.219 -0.512 0 CA-C-O 117.865 -1.064 . . . . 0.0 109.966 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 57.7 t80 . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -89.11 -3.65 58.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.821 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -72.26 142.72 48.93 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.595 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -148.59 134.38 18.92 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.6 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -150.64 138.85 20.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.401 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -175.94 138.49 0.36 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.589 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -152.64 148.34 20.55 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.286 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.74 157.6 59.86 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.994 2.463 . . . . 0.0 112.502 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -101.45 109.63 59.49 Favored Pre-proline 0 CA--C 1.533 0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.138 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.19 155.42 42.07 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 C-N-CA 122.666 2.244 . . . . 0.0 112.044 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.7 p -149.38 77.82 8.76 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.639 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -59.01 146.2 95.0 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.52 2.147 . . . . 0.0 112.032 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -121.99 146.37 47.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.362 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 71.0 ttt180 -96.22 -85.37 0.34 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.281 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 57.56 109.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.501 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.2 t -159.75 167.75 27.54 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.751 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -168.67 -157.84 11.93 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.095 -0.802 . . . . 0.0 111.095 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 61.64 60.18 1.68 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.649 0.262 . . . . 0.0 110.365 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.74 -35.86 75.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.885 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -125.57 161.52 27.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.923 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -65.47 -34.62 78.7 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.0 mmm -124.18 149.92 45.78 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.405 0.621 . . . . 0.0 110.648 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 52.5 mp0 -61.62 -41.71 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.424 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -46.08 -57.04 4.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.173 0.511 . . . . 0.0 110.494 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.5 mt -59.79 -35.38 74.55 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.867 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -64.55 -39.35 93.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.394 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.36 -46.87 88.41 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.14 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -59.77 -41.82 91.91 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.46 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 29.1 t-105 -59.92 -43.41 94.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 0.0 110.401 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -57.9 -41.98 83.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.206 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -61.25 -41.58 97.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.39 95.17 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.324 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.473 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 76.6 mt-30 -62.39 -38.4 89.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.32 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.527 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.0 mt -65.27 -38.37 90.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.446 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.35 109.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.3 mt -134.42 154.9 80.07 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -37.91 154.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.816 2.344 . . . . 0.0 112.202 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.95 -47.02 2.73 Favored 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.736 2.29 . . . . 0.0 112.551 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.432 HG23 ' N ' ' A' ' 41' ' ' ARG . 5.6 m -61.31 -47.18 94.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.452 -179.283 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.432 ' N ' HG23 ' A' ' 40' ' ' VAL . 61.4 ttm-85 -64.9 -40.64 95.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.434 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.14 -43.92 97.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.58 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.69 97.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.514 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -66.19 -47.09 75.06 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.618 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.01 -47.75 85.0 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.374 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.459 ' CD2' ' HD2' ' A' ' 50' ' ' LYS . 24.4 t60 -59.24 -41.25 88.3 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.293 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.415 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.55 -44.46 93.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.391 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -58.4 -45.79 87.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.137 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.1 mt -58.51 -41.49 85.53 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.178 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.459 ' HD2' ' CD2' ' A' ' 46' ' ' HIS . 51.6 mtpt -59.15 -39.84 83.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.062 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.0 mm -63.09 -43.02 98.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.858 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -56.4 -47.49 78.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.263 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -61.32 -44.36 97.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.107 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -60.02 -45.49 92.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.577 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.563 ' OD2' HD21 ' A' ' 77' ' ' LEU . 43.7 t0 -63.1 -37.83 88.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.655 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.0 -49.52 77.11 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.274 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.3 tp -59.44 -41.15 88.93 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.19 0.519 . . . . 0.0 110.163 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.56 -50.97 71.37 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.568 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.409 ' O ' ' HG ' ' A' ' 62' ' ' LEU . 70.5 t90 -57.82 -38.86 76.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.423 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -57.1 -45.77 83.13 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -60.59 -48.93 79.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.178 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.8 ' C ' HD12 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.03 -35.65 80.93 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.025 -0.67 . . . . 0.0 109.641 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.447 ' N ' ' HG ' ' A' ' 62' ' ' LEU . 29.3 tptp -61.26 -41.26 96.62 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 34.9 tp -60.19 -43.26 96.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.734 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -66.74 -35.35 79.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.999 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.3 67.49 1.36 Allowed Glycine 0 CA--C 1.52 0.365 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.618 ' O ' ' O ' ' A' ' 68' ' ' ASP . 99.1 mt -130.54 -86.99 0.51 Allowed 'General case' 0 N--CA 1.461 0.092 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.628 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.69 ' H ' HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER 53.15 141.55 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.438 179.579 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.528 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 83.5 tt0 -62.39 -51.98 65.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.868 0.366 . . . . 0.0 110.711 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 39.7 p30 -175.25 24.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.694 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.614 ' H ' ' CG ' ' A' ' 68' ' ' ASP . . . 89.34 -0.95 81.69 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -66.2 -32.67 74.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.713 0.292 . . . . 0.0 110.343 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.63 -49.45 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.268 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -62.33 -44.0 97.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.359 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.31 90.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.452 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -62.6 -42.45 99.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.911 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.563 HD21 ' OD2' ' A' ' 55' ' ' ASP . 84.5 mt -62.85 -44.57 95.77 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.057 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.65 -47.36 91.57 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.266 0.555 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.603 ' O ' HG23 ' A' ' 83' ' ' VAL . 60.8 ttp180 -61.35 -40.89 95.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.049 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -60.7 -41.2 94.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.373 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -60.21 -47.43 85.98 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.253 0.549 . . . . 0.0 110.049 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 28.6 t-20 -67.42 -37.53 83.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.56 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 79' ' ' ARG . 43.5 t -62.43 -48.27 89.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.441 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -61.44 -48.33 89.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.536 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.99 -42.19 97.26 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.85 87.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.348 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.76 -47.29 85.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.497 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -76.12 -21.14 56.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.439 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.98 27.51 70.33 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 90' ' ' LEU . 41.6 mt -86.98 -1.45 57.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.662 0.267 . . . . 0.0 110.592 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.412 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 59.3 t0 -60.78 -83.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.192 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 154.93 -167.39 32.72 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.092 -0.575 . . . . 0.0 111.797 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 94' ' ' LYS . 46.7 mttt -99.79 -176.61 3.31 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 93' ' ' LYS . 52.2 mttp 57.03 120.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.766 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -154.8 166.45 33.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.527 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 44.64 92.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.622 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.418 ' H ' ' HG2' ' A' ' 97' ' ' ARG . 60.2 mmt-85 -63.91 -44.85 91.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.851 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -179.67 -78.42 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.76 0.314 . . . . 0.0 110.638 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.632 HG12 ' H ' ' A' ' 100' ' ' THR . 0.8 OUTLIER 41.37 -155.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.92 0.39 . . . . 0.0 110.89 179.743 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.752 HG23 ' H ' ' A' ' 101' ' ' SER . 0.4 OUTLIER -156.94 -98.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.499 -179.903 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.752 ' H ' HG23 ' A' ' 100' ' ' THR . 45.6 p -141.58 167.86 21.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.464 ' CG ' ' O ' ' A' ' 101' ' ' SER . 13.3 p30 47.18 -167.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.529 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.516 ' C ' HD22 ' A' ' 104' ' ' LEU . 47.0 t -137.56 145.62 43.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.516 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.516 HD22 ' C ' ' A' ' 103' ' ' SER . 3.4 mm? -106.0 131.11 53.68 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.292 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 91.5 p -158.11 163.23 37.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.63 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 93.24 50.73 2.35 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 92.7 m -62.01 -45.03 95.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.684 0.278 . . . . 0.0 110.852 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -88.23 103.1 15.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.468 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 111' ' ' GLY . 70.0 mm-40 -70.67 -41.79 71.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.791 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 65.4 t0 49.17 -86.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.611 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 109' ' ' GLU . . . -154.13 -59.52 0.01 OUTLIER Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.721 -0.951 . . . . 0.0 110.721 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.929 ' N ' HD22 ' A' ' 112' ' ' LEU . 0.8 OUTLIER -89.22 127.38 35.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.736 0.303 . . . . 0.0 110.343 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -101.32 -42.9 6.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.7 -179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.411 ' HB2' HD13 ' A' ' 117' ' ' LEU . 3.3 m-20 -96.39 147.94 33.71 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.406 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.35 -30.54 29.95 Favored 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 122.646 2.231 . . . . 0.0 112.239 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 68.3 mtp85 -64.3 -43.62 94.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.881 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.578 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.0 mp -63.58 -38.89 92.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.714 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.408 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 99.1 mt-10 -56.17 -31.34 63.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.071 0.462 . . . . 0.0 110.444 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.593 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 99.6 mttt -64.66 -48.12 75.95 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.533 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 120' ' ' LEU . 50.7 mt -71.42 -45.83 61.71 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.983 0.42 . . . . 0.0 111.889 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.579 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.4 t-105 -58.67 -48.69 80.23 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.408 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 3.0 m80 -69.87 -32.59 71.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.378 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 13.1 tptt -59.31 -48.55 81.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.733 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.98 -47.61 65.16 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.696 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -57.23 -49.51 75.79 Favored 'General case' 0 C--O 1.23 0.04 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.121 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 5.2 m -74.91 -46.43 36.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.74 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 41.7 p -45.85 -29.26 1.3 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.122 -178.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -155.72 -95.63 0.11 Allowed Glycine 0 N--CA 1.463 0.489 0 C-N-CA 119.928 -1.129 . . . . 0.0 111.173 179.351 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.597 ' O ' ' N ' ' A' ' 131' ' ' SER . 26.9 mttm -163.86 27.87 0.08 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.492 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.6 m-30 -63.5 44.58 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.651 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.597 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.5 p -100.95 112.4 24.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.436 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 124.98 -97.12 0.53 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.076 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 134' ' ' GLU . 12.7 pt-20 -78.17 -42.88 30.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.854 0.359 . . . . 0.0 110.841 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.492 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 53.0 mp0 -60.63 -53.56 55.98 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.948 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.579 HD22 ' CE3' ' A' ' 121' ' ' TRP . 2.8 mt -61.84 -41.18 97.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.175 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -60.0 -44.53 94.49 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.085 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -59.61 -43.84 93.62 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.0 mm? -59.31 -42.53 91.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.293 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.532 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -64.94 -37.82 88.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.42 -0.809 . . . . 0.0 113.027 176.336 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 94.5 mtt180 -52.37 -43.72 64.85 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.64 -40.1 76.72 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.776 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.532 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.2 m-85 -58.36 -55.22 37.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.33 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 59.9 mt -59.66 -38.48 81.57 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.22 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.428 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 2.7 m-70 -54.1 -47.66 71.53 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.848 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -61.71 -39.19 90.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -60.34 -41.98 94.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.26 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -65.01 -55.17 20.52 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.823 0.344 . . . . 0.0 111.297 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.43 -45.22 94.08 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.987 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.468 HG22 HD13 ' A' ' 197' ' ' ILE . 51.5 t -64.1 -35.5 73.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.949 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.789 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -66.1 -41.75 90.2 Favored 'General case' 0 C--O 1.209 -1.042 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.014 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.9 -43.65 98.24 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.091 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.49 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 17.1 m-85 -70.5 -46.45 63.67 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.544 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ASN . . . . . 0.46 ' ND2' ' CG1' ' A' ' 149' ' ' VAL . 89.5 m-20 -67.55 -42.59 82.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.59 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 150' ' ' HIS . 76.2 t -61.54 -47.05 95.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.034 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 155' ' ' LEU . 46.5 mt -64.12 -44.58 91.8 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.62 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.666 HD21 HD21 ' A' ' 190' ' ' LEU . 19.5 mt -63.75 -43.54 96.15 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.659 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' GLU . . . . . 0.473 ' HA ' ' OG ' ' A' ' 160' ' ' SER . 69.3 mm-40 -65.65 -31.88 73.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.154 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 66.6 m -65.57 -49.15 69.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.722 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 pp -79.13 -21.13 46.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.514 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.473 ' OG ' ' HA ' ' A' ' 157' ' ' GLU . 93.2 p -66.89 -20.7 65.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.436 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -59.2 -42.01 89.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.911 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.81 31.57 0.61 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.633 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -137.15 -40.14 0.59 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.991 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 67.3 tt0 -92.38 24.51 3.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.971 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.452 HG13 ' N ' ' A' ' 166' ' ' HIS . 8.8 tp -55.5 155.23 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.466 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.452 ' N ' HG13 ' A' ' 165' ' ' ILE . 40.2 m80 -112.94 62.87 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.026 0.441 . . . . 0.0 110.015 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.17 26.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.514 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.46 ' ND2' ' O ' ' A' ' 170' ' ' ILE . 12.8 t30 -167.27 118.55 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.453 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 169' ' ' VAL . . . . . 0.47 ' O ' HG12 ' A' ' 169' ' ' VAL . 4.7 t -118.96 25.0 4.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.46 ' O ' ' ND2' ' A' ' 168' ' ' ASN . 9.9 tp -145.01 136.65 20.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.756 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.08 156.4 69.48 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.528 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.22 -5.59 16.38 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.823 2.349 . . . . 0.0 112.082 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 30.6 t -45.66 132.9 8.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.612 -179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -170.57 52.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.431 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.474 ' O ' ' OG ' ' A' ' 176' ' ' SER . 64.3 mt -105.8 38.45 2.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.619 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.474 ' OG ' ' O ' ' A' ' 175' ' ' LEU . 90.5 p 53.86 56.71 6.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.345 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 23.2 t0 54.79 30.02 12.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.525 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 24.1 mm 48.34 91.52 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.716 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -66.09 -40.64 90.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.532 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 148.06 0.02 0.58 Allowed Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 9.8 t -64.61 -43.08 94.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.015 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.648 HG12 ' N ' ' A' ' 183' ' ' LEU . 24.2 t -132.65 168.91 23.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.695 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.648 ' N ' HG12 ' A' ' 182' ' ' VAL . 3.1 mt 64.74 -16.37 0.09 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.879 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.594 ' H ' ' C ' ' A' ' 182' ' ' VAL . 2.1 p-80 -58.25 -41.1 83.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.531 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 11.4 t -61.56 -44.32 97.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.153 -179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.704 ' O ' HD13 ' A' ' 190' ' ' LEU . 79.3 mtp85 -61.75 -44.79 96.2 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.806 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -67.57 -38.36 83.98 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.386 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.1 m -63.19 -44.44 95.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.338 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.1 -44.9 90.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.354 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 186' ' ' ARG . 8.1 mp -62.83 -42.64 99.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.691 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.505 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.1 mttm -67.97 -34.2 76.09 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.935 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.544 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.6 tt0 -67.69 -47.6 68.97 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.218 0.532 . . . . 0.0 111.362 -178.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.49 ' CE ' ' CD1' ' A' ' 152' ' ' TYR . 12.4 ptmt -73.28 -40.64 64.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.44 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.822 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.9 -40.29 75.72 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.818 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.544 ' HG3' ' O ' ' A' ' 192' ' ' GLU . 3.4 ppt_? -65.6 -37.56 86.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 89.6 p -62.67 -43.88 97.68 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.468 HD13 HG22 ' A' ' 149' ' ' VAL . 96.8 mt -65.86 -43.34 93.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.782 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -60.87 -40.93 94.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.361 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.58 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 74.5 mt-30 -63.08 -38.56 91.66 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.576 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.76 -43.89 98.6 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 204' ' ' LEU . 18.9 mt -64.39 -39.04 93.09 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.01 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -59.76 -39.96 86.57 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.498 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 6.4 tmm_? -63.1 -42.68 99.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.393 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 201' ' ' LEU . 43.6 mt -61.86 -40.62 96.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.396 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -61.44 -41.68 97.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.749 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.704 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.1 mtp180 -62.3 -40.84 97.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.365 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.609 ' O ' ' N ' ' A' ' 211' ' ' GLY . 43.0 t -63.52 -46.09 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.083 0.468 . . . . 0.0 110.313 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -69.84 -26.65 64.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.508 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 41.1 m170 -101.81 -14.49 17.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.147 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 206' ' ' ARG . 64.1 tp60 -132.27 -37.84 1.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.765 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.609 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -52.86 -14.39 2.64 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.482 ' O ' ' N ' ' A' ' 214' ' ' THR . 2.7 m-85 -59.53 145.7 43.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.954 0.407 . . . . 0.0 110.688 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 27.4 t -50.39 89.58 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.348 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.482 ' N ' ' O ' ' A' ' 212' ' ' TYR . 24.4 p -124.13 10.1 8.72 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.888 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 65.09 103.73 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.067 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . 179.19 86.18 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.302 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -143.7 35.93 1.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.018 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.553 ' O ' ' HB3' ' A' ' 219' ' ' GLU . 4.3 m-85 -65.04 152.24 43.94 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 110.469 -0.196 . . . . 0.0 110.469 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.553 ' HB3' ' O ' ' A' ' 218' ' ' PHE . 83.3 tt0 74.61 -19.79 0.36 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 178.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 221' ' ' PRO . 32.4 mm-40 -89.65 150.95 45.16 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.615 ' O ' ' HB3' ' A' ' 222' ' ' ARG . 51.1 Cg_exo -51.54 -155.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.771 2.314 . . . . 0.0 111.874 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 221' ' ' PRO . 41.5 ttm180 87.62 -102.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.71 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.552 HG13 ' N ' ' A' ' 224' ' ' ILE . 14.4 p -59.15 -44.95 92.89 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 110.636 -179.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.552 ' N ' HG13 ' A' ' 223' ' ' VAL . 4.1 mm -61.6 -41.14 89.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.075 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -60.98 -39.65 90.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.91 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 7.7 mt -59.71 -41.81 91.64 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.28 0.562 . . . . 0.0 109.769 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.55 ' CZ3' HD13 ' A' ' 224' ' ' ILE . 54.8 m0 -61.42 -43.04 99.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.916 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.56 -25.52 65.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 232' ' ' SER . 2.8 mt -65.39 -43.33 91.02 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.93 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.438 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -34.8 -44.22 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.794 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -62.6 -47.91 81.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.652 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.547 ' O ' ' O ' ' A' ' 233' ' ' ALA . 35.7 t -67.6 -40.02 84.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.565 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 233' ' ' ALA . . . . . 0.547 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -47.93 -111.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.732 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -157.43 111.72 2.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 78.2 mt -146.36 161.64 39.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.579 ' OG1' ' HG2' ' A' ' 239' ' ' GLU . 0.0 OUTLIER -83.1 165.43 19.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.686 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -60.65 -47.38 86.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.991 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.1 -47.43 85.31 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 110.552 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.579 ' HG2' ' OG1' ' A' ' 236' ' ' THR . 5.7 mm-40 -66.3 -35.77 81.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.002 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.798 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.11 -43.31 98.79 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.206 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -63.01 -48.99 76.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.398 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.69 -44.18 97.43 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.344 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.585 ' HB2' ' HE ' ' A' ' 319' ' ' ARG . 0.6 OUTLIER -62.41 -43.87 97.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.122 179.062 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -59.37 -46.69 87.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.047 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -66.19 -44.07 85.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.706 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -59.66 -49.59 77.14 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.597 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.6 mm? -62.65 -38.32 89.84 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.525 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.41 -41.14 84.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.829 0.347 . . . . 0.0 110.071 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -66.51 -61.01 2.21 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.555 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 250' ' ' PHE . . . . . 0.434 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 25.3 t80 -59.58 -45.76 90.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.511 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.6 tp10 -54.88 -38.51 67.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.163 0.506 . . . . 0.0 109.701 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.31 82.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.244 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -60.72 -47.94 84.03 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.857 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.469 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 2.6 tp -63.49 -37.39 79.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.126 179.237 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -59.66 -44.02 93.72 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 121.07 0.462 . . . . 0.0 109.888 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -63.27 -42.41 99.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.134 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 257' ' ' HIS . . . . . 0.495 ' NE2' HG22 ' A' ' 297' ' ' THR . 15.5 t-80 -56.93 -42.43 80.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.159 0.504 . . . . 0.0 110.127 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -63.24 -40.0 96.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.084 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 259' ' ' HIS . . . . . 0.456 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -58.35 -46.58 86.0 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.147 0.499 . . . . 0.0 110.338 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -62.98 -35.68 80.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.201 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 261' ' ' GLN . . . . . 0.408 HE21 ' HB3' ' A' ' 261' ' ' GLN . 2.6 mm100 -60.48 -45.02 95.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.117 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -62.05 -43.76 98.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.209 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 263' ' ' GLN . . . . . 0.456 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.8 mp0 -66.92 -37.86 85.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.203 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 264' ' ' LEU . . . . . 0.891 HD21 ' OE1' ' A' ' 294' ' ' GLU . 53.9 tp -62.39 -43.54 98.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.294 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -66.21 -45.39 80.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.429 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 51.8 mt -62.94 -43.22 98.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.243 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.68 -37.82 82.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.253 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.77 -45.49 86.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.446 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -62.81 -46.44 87.96 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.618 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 60.5 tptt -60.48 -42.08 95.52 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.658 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.644 HD13 ' CB ' ' A' ' 286' ' ' SER . 35.4 tp -61.78 -43.15 99.43 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.27 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -58.13 -42.81 86.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.176 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -73.56 -33.71 64.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.506 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.744 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -64.04 -40.78 97.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.656 -179.673 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -54.26 -18.9 4.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.892 0.377 . . . . 0.0 110.594 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 4.1 t -62.32 -32.86 73.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.636 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.744 HG12 ' O ' ' A' ' 274' ' ' ALA . 10.4 p -58.67 -45.16 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.421 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.585 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 79.0 -10.26 34.42 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 279' ' ' ASP . . . . . 0.547 ' H ' HG13 ' A' ' 277' ' ' VAL . 54.1 m-20 -61.78 -38.6 88.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.661 0.267 . . . . 0.0 110.549 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 280' ' ' GLY . . . . . 0.661 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 98.11 -146.49 18.22 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 281' ' ' GLU . . . . . 0.458 ' OE1' ' C ' ' A' ' 280' ' ' GLY . 51.5 mp0 57.97 -65.03 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 110.778 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 282' ' ' ARG . . . . . 0.661 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -63.33 -37.97 89.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.665 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.81 -46.74 95.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.518 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 284' ' ' SER . . . . . 0.451 ' O ' ' OE1' ' A' ' 288' ' ' GLU . 12.0 t -63.1 -47.44 82.84 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.052 0.454 . . . . 0.0 110.933 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 73.3 ttp85 -64.11 -42.99 96.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.82 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 286' ' ' SER . . . . . 0.644 ' CB ' HD13 ' A' ' 271' ' ' LEU . 42.1 t -60.28 -43.79 95.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.453 -179.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 287' ' ' ARG . . . . . 0.636 ' NH2' ' CG ' ' A' ' 290' ' ' HIS . 5.5 mmp_? -64.12 -37.74 88.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.06 0.457 . . . . 0.0 110.677 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 288' ' ' GLU . . . . . 0.451 ' OE1' ' O ' ' A' ' 284' ' ' SER . 0.4 OUTLIER -60.22 -56.38 22.21 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.324 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.447 ' HD3' HD23 ' A' ' 292' ' ' LEU . 28.3 mmtt -65.57 -34.94 79.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.979 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 290' ' ' HIS . . . . . 0.636 ' CG ' ' NH2' ' A' ' 287' ' ' ARG . 42.8 t-80 -51.84 -48.68 63.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.66 -37.01 79.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.541 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.447 HD23 ' HD3' ' A' ' 289' ' ' LYS . 14.6 tp -62.2 -49.93 73.79 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.555 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 293' ' ' LEU . . . . . 0.463 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.4 mp -62.91 -41.33 99.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.134 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.891 ' OE1' HD21 ' A' ' 264' ' ' LEU . 29.5 tp10 -62.99 -41.25 99.52 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -59.51 -48.22 87.08 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.15 -40.23 89.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 0.0 110.231 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.495 HG22 ' NE2' ' A' ' 257' ' ' HIS . 0.2 OUTLIER -56.84 -47.48 80.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.105 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -63.12 -42.41 99.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.452 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.73 -47.55 76.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.479 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 300' ' ' LEU . . . . . 0.422 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.5 OUTLIER -60.24 -43.44 96.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.512 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.82 -42.02 84.8 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 302' ' ' TYR . . . . . 0.602 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 53.5 t80 -62.66 -46.62 87.34 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.422 0.629 . . . . 0.0 110.587 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 303' ' ' THR . . . . . 0.417 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 15.7 m -61.69 -45.93 91.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.454 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.51 -30.74 50.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.203 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -62.6 -55.04 30.87 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 121.141 0.496 . . . . 0.0 110.516 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 306' ' ' LYS . . . . . 0.602 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 77.5 mttt -62.17 -42.67 99.49 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.81 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.417 ' ND1' ' O ' ' A' ' 303' ' ' THR . 60.2 m80 -63.9 -32.01 73.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.988 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.425 HD23 ' CH2' ' A' ' 227' ' ' TRP . 1.6 mt -62.75 -48.44 79.19 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -66.84 -41.1 87.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.697 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -62.08 -49.12 77.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.793 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.453 ' HA ' HD23 ' A' ' 311' ' ' LEU . 26.6 mt -63.51 -40.58 97.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.029 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 6.7 t -60.02 -44.31 94.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.29 -44.86 84.31 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.705 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -65.84 -43.61 87.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.877 0.37 . . . . 0.0 111.114 -179.599 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.3 mm -69.76 -24.02 26.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 67.7 m -59.14 -43.13 92.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.204 0.526 . . . . 0.0 110.057 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.86 -2.66 34.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.251 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.741 ' O ' HD21 ' A' ' 323' ' ' LEU . . . 61.62 -141.84 0.46 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.524 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.585 ' HE ' ' HB2' ' A' ' 243' ' ' PHE . 1.5 mpt_? -108.7 -82.08 0.56 Allowed 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.407 -178.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 74.2 -11.27 1.01 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.032 0.444 . . . . 0.0 110.595 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.425 ' H ' ' C ' ' A' ' 319' ' ' ARG . 16.0 p-10 -176.85 35.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.516 ' CA ' ' OE1' ' A' ' 239' ' ' GLU . 81.4 tt0 56.74 154.19 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.543 -178.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.741 HD21 ' O ' ' A' ' 318' ' ' ALA . 5.3 mt . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 117.866 -1.064 . . . . 0.0 110.599 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 93.8 p -75.51 171.1 14.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.522 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.469 ' HD3' HH11 ' A' ' 3' ' ' ARG . 42.7 ttp-105 65.23 125.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.575 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -132.66 156.65 46.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.147 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -111.14 138.99 46.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.622 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.408 ' OD1' ' O ' ' A' ' 6' ' ' ASN . 17.5 p30 -160.78 128.71 4.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.541 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -141.94 60.68 11.37 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.899 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' O ' ' CB ' ' A' ' 9' ' ' LYS . 72.3 Cg_endo -75.11 149.57 36.46 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 123.028 2.485 . . . . 0.0 112.391 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.439 ' CB ' ' O ' ' A' ' 8' ' ' PRO . 23.0 tttp 164.88 130.42 0.03 OUTLIER Pre-proline 0 CA--C 1.534 0.335 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.353 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.33 155.29 60.57 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 122.373 2.049 . . . . 0.0 111.802 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.8 p -89.14 130.53 43.92 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.858 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -76.2 -18.64 16.09 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.864 2.376 . . . . 0.0 112.028 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -85.01 159.4 20.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.592 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -129.24 148.68 51.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.278 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -119.2 124.58 47.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.62 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.9 t -156.9 152.69 27.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.518 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -94.51 -172.61 38.15 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.834 -0.907 . . . . 0.0 110.834 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -108.72 124.7 50.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.717 0.294 . . . . 0.0 110.331 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -79.64 -12.65 59.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.733 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -132.13 167.22 20.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.777 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -61.19 -40.34 93.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 88.8 mmm -121.25 149.08 43.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.418 0.627 . . . . 0.0 111.074 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 23' ' ' GLU . 4.2 pm0 -61.58 -40.33 94.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.435 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -52.31 -48.79 65.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.179 0.514 . . . . 0.0 110.668 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.81 -39.47 91.87 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.359 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.9 t-20 -62.91 -38.82 92.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.189 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -61.74 -43.52 98.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.354 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.29 -42.68 99.06 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -61.16 -47.14 87.56 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.234 0.54 . . . . 0.0 110.44 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -57.51 -41.99 81.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -61.23 -43.1 99.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.238 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.87 88.11 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.071 0.462 . . . . 0.0 110.082 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.446 ' O ' ' ND1' ' A' ' 36' ' ' HIS . 24.5 mt-30 -59.41 -39.31 83.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.173 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.567 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 61.6 ttt85 -60.96 -39.88 91.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.373 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.67 -34.53 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.296 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.567 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 66.4 m-70 66.41 118.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.5 mt -137.13 154.61 75.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.115 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 79.4 Cg_exo -41.74 154.62 0.09 OUTLIER 'Trans proline' 0 C--N 1.312 -1.354 0 C-N-CA 122.504 2.136 . . . . 0.0 112.41 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 34.1 Cg_exo -56.5 -47.49 23.69 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.511 2.141 . . . . 0.0 112.375 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.8 -45.71 94.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.447 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpt180 -62.52 -41.89 99.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.58 -43.61 98.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.715 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.26 89.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.595 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -68.67 -42.38 77.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.528 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.729 HD13 ' OH ' ' A' ' 88' ' ' TYR . 50.9 tp -63.04 -48.67 77.74 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.23 0.538 . . . . 0.0 110.661 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -59.96 -42.77 94.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.25 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.615 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.33 -46.56 88.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.607 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -55.8 -47.78 76.53 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.485 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.0 -40.74 85.82 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.139 0.495 . . . . 0.0 109.988 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.49 -39.14 82.77 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.947 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 47' ' ' ALA . 35.9 mm -62.83 -42.71 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.59 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -55.79 -46.79 77.89 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.444 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -60.06 -50.48 73.56 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.355 0.597 . . . . 0.0 110.419 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.313 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -61.21 -40.57 94.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.385 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.18 -51.02 67.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.05 -39.65 93.09 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.242 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.5 92.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.63 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.459 ' CZ3' ' HD3' ' A' ' 63' ' ' LYS . 89.3 t90 -61.87 -40.26 94.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.267 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.76 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 87.8 tttt -57.61 -49.33 76.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.463 0.649 . . . . 0.0 109.556 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -66.46 -41.27 89.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.182 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.46 -44.16 97.59 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.618 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.76 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 18.4 pttm -61.93 -39.19 91.19 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 63' ' ' LYS . 56.5 tp -58.63 -44.09 89.93 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.509 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -64.87 -37.64 88.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.191 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 92.13 56.95 1.53 Allowed Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 95.5 mt -116.83 -10.44 11.04 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.798 0.332 . . . . 0.0 110.76 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.549 ' OD2' ' N ' ' A' ' 71' ' ' GLY . 5.1 t70 -77.57 121.9 24.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.243 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.441 ' OE1' ' OE2' ' A' ' 72' ' ' GLU . 94.1 mt-10 -49.87 -85.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.793 -179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -131.32 42.78 3.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.795 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.549 ' N ' ' OD2' ' A' ' 68' ' ' ASP . . . 80.3 18.48 71.44 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.441 ' OE2' ' OE1' ' A' ' 69' ' ' GLU . 96.0 mt-10 -60.61 -35.03 75.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.796 0.331 . . . . 0.0 110.361 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -62.07 -48.32 80.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.23 0.538 . . . . 0.0 110.003 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.37 -39.32 90.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.252 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.41 94.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.208 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -63.66 -39.74 95.1 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.466 -0.493 . . . . 0.0 109.754 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.7 mt -62.62 -45.23 93.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.431 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.24 -44.58 95.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.056 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.755 ' O ' HG23 ' A' ' 83' ' ' VAL . 63.3 ttm-85 -58.1 -42.63 86.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.885 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.428 ' O ' HG13 ' A' ' 84' ' ' ILE . 75.2 m-20 -62.72 -39.62 94.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.308 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -57.78 -49.63 75.96 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.96 -179.359 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.446 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 53.9 t-20 -64.68 -37.37 87.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.336 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 79' ' ' ARG . 72.7 t -63.16 -45.8 97.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.466 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.17 -50.34 80.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.061 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.438 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.6 mm? -65.44 -39.77 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.769 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.84 -45.23 95.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.65 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -62.83 -45.87 90.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.849 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.729 ' OH ' HD13 ' A' ' 45' ' ' LEU . 8.7 m-85 -64.44 -28.04 69.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.297 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.18 23.29 61.45 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.7 mt -93.8 2.32 56.24 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.8 0.333 . . . . 0.0 110.398 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -84.87 -1.95 57.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.572 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -59.58 163.38 13.44 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.289 -0.725 . . . . 0.0 111.289 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -133.21 170.84 14.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.752 0.31 . . . . 0.0 110.755 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.531 ' O ' ' O ' ' A' ' 95' ' ' ASP . 99.2 mttt -56.13 -76.53 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.636 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.634 ' O ' ' N ' ' A' ' 97' ' ' ARG . 37.6 t70 55.91 137.42 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.69 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 58.15 -68.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.456 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.634 ' N ' ' O ' ' A' ' 95' ' ' ASP . 70.8 ttt180 58.62 154.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.446 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.1 142.36 56.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.184 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 34.8 m -129.21 157.73 41.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.23 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.427 ' O ' ' ND2' ' A' ' 102' ' ' ASN . 27.1 m -63.53 134.32 55.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.033 -179.576 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 20.8 p -60.11 142.85 53.52 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.324 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.427 ' ND2' ' O ' ' A' ' 100' ' ' THR . 70.7 m-80 -159.44 35.76 0.2 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.672 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 79.7 p -69.57 -12.54 61.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.45 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.59 -39.81 92.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.681 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 39.4 t -58.07 -43.36 86.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.391 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 79.9 -94.0 1.42 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 92.8 m -118.79 129.09 55.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.921 0.391 . . . . 0.0 110.482 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -135.97 74.77 1.52 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.521 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -157.54 113.42 2.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.506 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.464 ' O ' ' OD1' ' A' ' 110' ' ' ASP . 51.3 p-10 -151.86 88.5 1.4 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.511 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.85 ' HA3' ' NE2' ' A' ' 122' ' ' HIS . . . -64.24 -41.81 98.13 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 37.6 tp -160.31 -84.29 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.648 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -163.56 -65.27 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.661 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.94 128.02 77.89 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.434 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.436 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 50.3 Cg_exo -51.19 -39.54 61.54 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 122.422 2.081 . . . . 0.0 112.502 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 82.5 mtm180 -61.03 -45.44 94.76 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.984 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.1 mt -68.33 -40.14 81.71 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.234 0.54 . . . . 0.0 110.664 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.56 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 96.8 mt-10 -58.81 -33.18 70.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.333 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 56.6 mttp -60.8 -47.97 83.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.712 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.19 -45.82 86.65 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.206 0.527 . . . . 0.0 111.928 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.487 ' CE3' HD22 ' A' ' 135' ' ' LEU . 14.3 t-105 -60.86 -51.5 69.05 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.975 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.85 ' NE2' ' HA3' ' A' ' 111' ' ' GLY . 9.7 m-70 -68.88 -29.32 67.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.234 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.634 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.1 tptt -57.6 -49.97 74.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.452 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.404 ' HB1' ' CB ' ' A' ' 130' ' ' PHE . . . -71.68 -47.56 53.33 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 119.3 -0.96 . . . . 0.0 111.022 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.427 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 38.3 ttmt -53.21 -48.47 68.1 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.875 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 10.5 m -78.91 -43.28 25.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.897 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.589 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 18.0 m -44.73 -28.49 0.63 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -163.87 -96.03 0.11 Allowed Glycine 0 C--N 1.321 -0.259 0 C-N-CA 119.684 -1.246 . . . . 0.0 111.576 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.702 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -152.02 20.5 0.68 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.46 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 2.6 m-85 -59.53 41.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.613 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.798 ' HA ' HD12 ' A' ' 135' ' ' LEU . 5.5 p -103.0 114.46 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.976 0.417 . . . . 0.0 111.247 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.502 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 120.92 -96.88 0.61 Allowed Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.788 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.47 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 79.7 mm-40 -72.97 -43.77 61.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.909 0.385 . . . . 0.0 111.342 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 4.1 mp0 -65.52 -45.8 82.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.126 0.489 . . . . 0.0 110.165 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 131' ' ' SER . 1.7 mt -60.64 -41.9 95.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.898 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.502 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -63.01 -40.23 97.15 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.92 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -59.56 -44.36 93.3 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 121.273 0.558 . . . . 0.0 110.207 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.1 mm? -60.84 -42.52 97.94 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -30.67 70.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 176.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 136' ' ' ASP . 59.6 mmt-85 -59.02 -44.16 91.69 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.432 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -71.02 -39.44 72.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.859 179.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.27 -58.28 9.2 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.565 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 143' ' ' LEU . 93.9 mt -61.0 -39.29 89.12 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.218 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -55.25 -43.02 74.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.441 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.525 ' CD2' HG23 ' A' ' 197' ' ' ILE . 5.7 m80 -64.84 -38.23 90.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.075 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -59.64 -45.03 93.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.403 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -70.48 -51.74 26.91 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.739 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.442 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 14.5 mptt -62.54 -44.51 96.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.157 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.453 HG22 ' ND2' ' A' ' 153' ' ' ASN . 2.6 p -63.77 -35.95 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.501 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.776 ' O ' HG23 ' A' ' 154' ' ' VAL . 1.9 m170 -66.01 -43.23 88.32 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.665 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.99 -44.7 96.18 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.364 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.442 ' CD2' ' O ' ' A' ' 148' ' ' LYS . 31.4 m-85 -69.58 -46.76 65.61 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.904 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ASN . . . . . 0.453 ' ND2' HG22 ' A' ' 149' ' ' VAL . 62.4 m-20 -65.59 -41.07 93.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.103 0.478 . . . . 0.0 110.527 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 150' ' ' HIS . 63.8 t -63.08 -43.92 99.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.674 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 44.7 mt -62.66 -44.24 96.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.561 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 15.7 mt -63.74 -42.68 97.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.699 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -68.81 -25.52 64.72 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.933 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 58.5 m -70.63 -47.43 60.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.852 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.9 pp -78.72 -24.44 44.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.621 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 97.6 p -60.81 -42.93 98.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.69 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -64.42 -43.29 94.83 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 -179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 3.1 m -85.2 38.91 0.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.501 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -126.62 -27.14 3.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.0 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -100.75 23.07 11.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.339 0.59 . . . . 0.0 110.105 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.6 tt -57.15 136.99 19.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.741 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.648 ' C ' ' H ' ' A' ' 168' ' ' ASN . 22.0 m-70 -135.79 26.01 3.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.05 0.453 . . . . 0.0 109.98 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.498 ' O ' ' HG2' ' A' ' 167' ' ' GLU . 78.5 tt0 -65.02 25.54 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.393 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.648 ' H ' ' C ' ' A' ' 166' ' ' HIS . 29.1 p30 -174.39 -165.93 0.24 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.453 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 6.3 p -81.23 135.34 25.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.437 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.408 ' O ' HG23 ' A' ' 170' ' ' ILE . 20.1 tt -85.74 133.71 28.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.53 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 171' ' ' SER . . . . . 0.619 ' O ' ' N ' ' A' ' 173' ' ' SER . 0.0 OUTLIER -139.44 161.55 56.42 Favored Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.211 179.868 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -46.98 75.02 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 122.812 2.342 . . . . 0.0 112.263 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.619 ' N ' ' O ' ' A' ' 171' ' ' SER . 87.6 p -163.6 159.32 21.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.685 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -123.29 -9.96 8.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.343 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.562 ' O ' ' N ' ' A' ' 177' ' ' ASP . 4.0 tp -157.08 169.23 25.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.4 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.503 ' H ' ' HG ' ' A' ' 175' ' ' LEU . 38.1 t -60.15 72.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.29 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.562 ' N ' ' O ' ' A' ' 175' ' ' LEU . 52.8 t0 48.99 106.14 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.832 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 3.3 pt -130.96 133.06 63.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.765 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -98.29 19.45 14.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.351 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 91.44 32.24 8.9 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 37.4 m -62.16 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.835 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.604 ' O ' ' N ' ' A' ' 184' ' ' HIS . 4.3 t -142.09 -130.38 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.543 -179.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.593 ' H ' HG12 ' A' ' 182' ' ' VAL . 4.9 tt 61.54 -49.65 0.13 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.838 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.604 ' N ' ' O ' ' A' ' 182' ' ' VAL . 30.0 p-80 -58.71 -43.69 90.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.505 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.557 ' N ' ' CG ' ' A' ' 184' ' ' HIS . 59.2 m -64.42 -41.78 96.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.544 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 75.3 mtm180 -64.44 -46.77 81.7 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.581 -0.448 . . . . 0.0 112.054 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 187' ' ' HIS . . . . . 0.647 ' C ' ' ND1' ' A' ' 187' ' ' HIS . 0.1 OUTLIER -71.97 -34.77 69.23 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.785 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 188' ' ' THR . . . . . 0.627 ' N ' ' ND1' ' A' ' 187' ' ' HIS . 59.6 m -62.88 -46.13 89.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.82 179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 193' ' ' LYS . 75.7 mm-40 -62.49 -34.33 76.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.573 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 187' ' ' HIS . 21.1 mt -61.16 -41.62 97.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.932 0.396 . . . . 0.0 110.208 178.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.652 ' HA ' HD23 ' A' ' 194' ' ' LEU . 68.1 mttm -67.68 -35.92 79.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.815 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 79.8 mm-40 -67.06 -45.65 76.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.981 0.42 . . . . 0.0 111.492 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.543 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 4.5 ptmt -69.25 -36.54 77.25 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.936 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.826 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -62.53 -44.11 97.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.989 -179.521 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.533 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 16.0 ptm180 -65.78 -35.87 81.93 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.417 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.44 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 72.4 m -59.5 -40.56 87.43 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.525 HG23 ' CD2' ' A' ' 145' ' ' HIS . 96.6 mt -63.76 -42.98 97.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.399 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -58.84 -41.99 88.24 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -61.61 -38.54 88.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.33 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.55 -41.68 97.36 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.213 -1.155 . . . . 0.0 110.213 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 204' ' ' LEU . 20.4 mt -61.94 -40.14 94.5 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.672 178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -62.04 -36.53 81.87 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.464 ' HD3' ' O ' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -62.45 -42.49 99.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.248 178.832 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 201' ' ' LEU . 32.4 mt -60.19 -39.36 86.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.451 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -60.44 -41.8 94.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.604 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.603 ' O ' ' N ' ' A' ' 210' ' ' GLN . 25.9 mmt85 -62.43 -38.62 90.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.117 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.591 ' O ' ' N ' ' A' ' 211' ' ' GLY . 30.4 t -63.64 -45.09 98.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.302 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -66.13 -28.17 68.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.471 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -94.64 -39.45 10.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.026 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.603 ' N ' ' O ' ' A' ' 206' ' ' ARG . 56.2 tt0 -96.16 -40.46 9.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.399 . . . . 0.0 110.715 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -84.16 30.58 3.61 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.524 ' CE1' ' OG ' ' A' ' 127' ' ' SER . 87.4 t80 -59.36 -48.29 82.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.66 0.267 . . . . 0.0 110.673 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.704 ' OG ' ' N ' ' A' ' 214' ' ' THR . 18.8 p -172.51 -85.39 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.676 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.704 ' N ' ' OG ' ' A' ' 213' ' ' SER . 0.5 OUTLIER 175.48 173.77 0.27 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.489 -179.681 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.569 ' OE1' ' N ' ' A' ' 215' ' ' GLU . 56.6 mp0 -112.9 179.99 3.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.446 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . 63.07 123.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.234 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -137.6 35.48 2.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.0 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.638 ' HD1' ' N ' ' A' ' 218' ' ' PHE . 0.0 OUTLIER -59.32 -14.74 12.62 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.369 -179.862 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.479 ' HG3' ' CE1' ' A' ' 218' ' ' PHE . 96.9 mt-10 -65.63 -41.01 93.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.049 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.623 ' C ' ' H ' ' A' ' 222' ' ' ARG . 7.3 mt-10 41.12 103.69 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.264 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.486 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 32.1 Cg_exo -57.97 15.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 123.023 2.482 . . . . 0.0 112.243 177.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.623 ' H ' ' C ' ' A' ' 220' ' ' GLU . 84.8 mtt85 -112.66 -59.81 1.96 Allowed 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.853 0.359 . . . . 0.0 110.692 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.899 HG13 ' H ' ' A' ' 224' ' ' ILE . 6.2 p -65.37 -64.61 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-O 121.404 0.621 . . . . 0.0 111.326 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.899 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -62.3 -32.39 54.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.721 -179.151 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 225' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 21.8 t70 -63.0 -40.74 98.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.303 0.573 . . . . 0.0 109.836 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.8 mt -61.42 -40.78 95.66 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.572 ' CH2' HD23 ' A' ' 308' ' ' LEU . 40.0 m0 -59.75 -38.28 81.33 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.059 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -63.22 -37.55 87.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.443 ' HA ' HD23 ' A' ' 229' ' ' LEU . 93.3 mt -63.96 -41.86 97.45 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.366 0.603 . . . . 0.0 110.199 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -50.03 -14.88 0.17 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.835 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.578 ' O ' HD21 ' A' ' 240' ' ' LEU . 18.3 pt20 -64.82 -42.83 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.759 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.5 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 23.7 m -136.95 58.03 1.74 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -109.28 45.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.403 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 234' ' ' ASN . . . . . 0.578 ' C ' HD22 ' A' ' 235' ' ' LEU . 50.2 t-20 65.84 53.38 1.15 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.998 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.578 HD22 ' C ' ' A' ' 234' ' ' ASN . 4.2 mm? -108.56 177.87 4.66 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.066 0.46 . . . . 0.0 110.447 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.477 ' OG1' ' CG ' ' A' ' 239' ' ' GLU . 60.6 p -84.57 -176.23 6.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.477 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -85.47 -50.78 7.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.202 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -62.01 -44.72 96.12 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.033 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.477 ' CG ' ' OG1' ' A' ' 236' ' ' THR . 85.8 mt-10 -61.87 -34.28 75.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.578 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -64.77 -42.08 95.39 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.837 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -64.3 -49.09 73.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.512 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.42 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.126 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.3 -43.25 95.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.456 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -56.43 -51.28 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 110.381 -178.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -66.54 -39.95 88.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.744 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -58.89 -53.99 52.13 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.207 0.527 . . . . 0.0 110.447 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 247' ' ' LEU . 4.5 mm? -64.08 -33.81 76.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.444 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.716 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.9 tttt -57.28 -44.96 84.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.224 0.535 . . . . 0.0 110.072 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -68.96 -44.04 73.77 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.604 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -61.24 -47.2 87.15 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 120.991 0.424 . . . . 0.0 111.088 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.716 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.0 OUTLIER -61.28 -36.27 79.58 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.72 87.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.69 -48.16 80.5 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.233 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.524 HD11 ' CE2' ' A' ' 218' ' ' PHE . 1.2 tt -65.02 -34.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.096 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -64.57 -44.73 89.8 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.34 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.82 -44.31 96.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.332 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -44.8 73.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -60.71 -40.76 93.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.29 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -59.78 -47.22 86.57 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.515 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -63.94 -34.52 78.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.397 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -61.8 -46.87 87.66 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.189 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.99 -46.76 87.83 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.05 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -64.38 -34.96 79.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.987 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 60.5 tp -62.62 -42.9 99.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -64.81 -44.66 89.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.712 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.42 -43.26 98.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.192 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.4 -38.6 87.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.099 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -61.54 -46.79 88.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.87 -49.12 78.93 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -61.89 -38.75 89.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.516 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.04 -43.06 99.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.261 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -60.27 -43.27 96.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.403 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -65.9 -39.88 91.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.29 -38.32 89.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.941 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -63.9 -30.37 71.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.517 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 6.4 t -59.39 -40.16 85.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.536 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 91.5 t -60.75 -45.31 97.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.495 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 86.35 18.72 58.45 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.03 -38.24 90.36 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.292 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 280' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 81.47 -164.76 45.73 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 63.27 -70.58 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.8 0.333 . . . . 0.0 110.619 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 282' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 280' ' ' GLY . 11.2 ptp85 -67.97 -24.56 65.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.825 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.9 -47.59 92.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.421 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 38.6 t -66.55 -44.86 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.18 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.03 -49.49 77.19 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.876 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 71.7 m -60.83 -43.96 97.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -63.63 -39.06 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.724 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -58.36 -57.18 14.02 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.95 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.686 ' HD3' HD23 ' A' ' 292' ' ' LEU . 17.1 mmtm -64.28 -36.49 84.27 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.077 179.159 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -49.23 -50.05 40.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.78 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.4 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.601 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.686 HD23 ' HD3' ' A' ' 289' ' ' LYS . 22.8 tp -59.98 -49.72 76.58 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.548 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.17 -42.07 99.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.014 0.435 . . . . 0.0 109.891 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.59 ' O ' ' OG1' ' A' ' 297' ' ' THR . 12.3 tm-20 -60.97 -40.12 92.2 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.04 -43.22 99.46 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.26 -43.95 98.04 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.227 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.59 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 25.3 p -57.36 -43.86 83.87 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.99 0.424 . . . . 0.0 110.121 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -62.79 -46.36 88.36 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.137 0.494 . . . . 0.0 110.681 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.52 -39.92 89.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.144 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.85 -43.86 98.0 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.152 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.72 -42.55 96.42 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -61.52 -44.89 96.25 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.137 0.494 . . . . 0.0 110.616 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.3 m -60.52 -43.93 96.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.352 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.8 t -59.81 -42.76 90.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.921 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.71 -50.51 72.97 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.031 0.443 . . . . 0.0 110.596 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -63.77 -41.18 98.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.682 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -66.23 -34.98 79.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.011 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.664 HD22 HG21 ' A' ' 223' ' ' VAL . 19.3 mt -62.14 -43.72 98.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.378 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -68.53 -43.87 75.83 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.737 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -64.15 -49.53 71.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.112 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 311' ' ' LEU . 28.1 mt -63.89 -41.32 97.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.9 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 74.7 m -59.64 -41.81 91.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.545 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -68.4 -47.47 57.49 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.445 ' HB3' HD13 ' A' ' 323' ' ' LEU . 89.0 mtm180 -66.1 -42.35 89.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.785 0.326 . . . . 0.0 111.269 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -70.23 -23.75 25.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.94 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.4 t -59.66 -43.84 93.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 109.735 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -100.82 4.31 42.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.732 179.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.547 ' O ' HD21 ' A' ' 323' ' ' LEU . . . 54.57 -101.83 0.13 Allowed 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.288 -178.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.454 ' HB3' HD21 ' A' ' 323' ' ' LEU . 0.0 OUTLIER -177.37 146.82 0.49 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.989 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -94.24 -26.16 16.76 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 37.5 p-10 -160.8 65.34 0.3 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.464 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 60.06 147.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.315 -179.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.547 HD21 ' O ' ' A' ' 318' ' ' ALA . 28.0 mt . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.552 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.492 ' CD1' ' O ' ' A' ' 2' ' ' SER . 55.4 t80 . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.492 ' O ' ' CD1' ' A' ' 1' ' ' TYR . 48.2 t -66.06 149.2 50.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.641 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -128.95 141.43 51.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.73 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -131.21 127.25 37.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.414 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -132.8 149.76 52.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.24 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -77.35 142.25 39.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.983 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -147.23 149.76 35.91 Favored Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.459 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.58 149.2 90.28 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.508 2.139 . . . . 0.0 112.174 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt -145.18 87.72 7.04 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.593 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.432 ' O ' ' CB ' ' A' ' 11' ' ' SER . 52.1 Cg_exo -52.07 -39.33 70.5 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.61 2.206 . . . . 0.0 112.053 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 10' ' ' PRO . 1.4 t 77.78 80.23 0.12 Allowed Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.23 146.77 93.52 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 123.126 2.55 . . . . 0.0 112.358 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -64.55 134.66 54.85 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.526 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.8 mtp180 -99.75 134.99 41.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.51 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -78.14 -82.23 0.09 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.63 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m 59.75 117.85 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.842 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.449 ' O ' ' O ' ' A' ' 18' ' ' GLU . . . -63.47 -40.41 98.77 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.834 -0.907 . . . . 0.0 110.834 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.449 ' O ' ' O ' ' A' ' 17' ' ' GLY . 79.9 mm-40 54.97 114.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.883 0.373 . . . . 0.0 110.82 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -65.58 -40.68 92.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.745 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -104.67 -175.08 2.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.489 ' C ' ' SD ' ' A' ' 22' ' ' MET . 85.5 mtp180 -92.38 -4.08 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.78 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.538 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -133.56 137.98 45.8 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.027 0.441 . . . . 0.0 111.109 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 16.6 pt-20 -65.12 -42.59 93.77 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' H ' ' HG2' ' A' ' 24' ' ' LYS . 13.2 pttm -57.0 -45.42 83.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.0 0.429 . . . . 0.0 109.963 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.1 mp -61.62 -41.51 97.58 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.1 m-80 -62.09 -38.75 90.03 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.199 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -59.01 -48.78 80.36 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.885 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.436 ' N ' HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -61.97 -42.14 98.79 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.116 179.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.645 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 61.1 t-105 -61.12 -45.06 96.23 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.072 0.463 . . . . 0.0 110.383 179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.439 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 81.3 tt0 -56.85 -46.04 82.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.372 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -61.71 -40.56 95.48 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.474 -0.491 . . . . 0.0 110.281 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.91 -43.9 86.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.645 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 88.2 mt-30 -62.81 -38.5 90.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.232 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.439 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -61.19 -41.66 97.21 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.376 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.17 -41.17 97.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.337 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.401 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.2 OUTLIER 65.33 104.83 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.764 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.522 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -125.47 158.51 64.2 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.354 179.614 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -39.12 153.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.478 0 C-N-CA 122.593 2.195 . . . . 0.0 112.417 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.5 -41.77 68.25 Favored 'Trans proline' 0 N--CA 1.499 1.837 0 C-N-CA 122.812 2.341 . . . . 0.0 112.538 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 70.6 t -62.69 -46.42 96.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -64.76 -38.52 91.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.335 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.25 -46.08 88.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.18 -42.67 83.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.866 0.365 . . . . 0.0 110.816 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -67.63 -45.27 75.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.564 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.52 HD13 ' OH ' ' A' ' 88' ' ' TYR . 59.3 tp -63.13 -48.89 76.57 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.523 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -60.3 -41.31 93.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.282 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.583 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.97 -50.41 74.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -57.65 -48.11 80.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.946 0.403 . . . . 0.0 110.996 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.71 -39.82 81.91 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.01 -40.46 89.34 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.882 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.583 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.6 mm -62.45 -43.84 98.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -58.42 -42.89 88.28 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.684 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.49 -49.56 77.05 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.155 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -63.0 -41.57 99.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.792 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 55' ' ' ASP . 48.5 t0 -63.34 -39.38 94.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.356 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.33 -46.38 90.51 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.848 0.356 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.6 tp -61.4 -43.52 98.73 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.722 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.411 ' O ' HD13 ' A' ' 62' ' ' LEU . . . -61.98 -44.5 96.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.696 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.3 t90 -56.33 -42.45 77.7 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.2 tttt -60.52 -45.92 92.03 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.688 -0.405 . . . . 0.0 109.977 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -60.47 -42.64 96.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.265 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 58' ' ' ALA . 10.3 mp -62.03 -40.64 96.4 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.341 -0.544 . . . . 0.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.96 -40.72 85.6 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.642 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.5 tt -60.67 -44.63 96.24 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -63.84 -37.33 86.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.307 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.98 52.92 1.57 Allowed Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 77.7 mt -112.21 -51.17 2.86 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.848 0.356 . . . . 0.0 110.986 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -66.27 138.08 57.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.333 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -159.36 -30.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.503 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 71' ' ' GLY . 47.5 p-10 -64.92 -34.26 77.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.594 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.539 ' N ' ' OD1' ' A' ' 70' ' ' ASP . . . 89.13 2.35 77.71 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -66.81 -34.39 77.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.453 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.491 ' HD2' ' H ' ' A' ' 73' ' ' LYS . 2.7 mptp? -61.44 -68.09 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.074 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -51.74 -39.14 57.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.367 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.53 95.11 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.412 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.487 ' NH1' HD21 ' A' ' 80' ' ' ASN . 73.7 ttt-85 -62.62 -43.07 99.73 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.01 -43.37 98.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.573 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.58 -44.69 98.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.148 0.499 . . . . 0.0 109.95 179.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.553 ' O ' HG23 ' A' ' 83' ' ' VAL . 7.9 mmp_? -59.86 -41.74 92.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.236 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.487 HD21 ' NH1' ' A' ' 76' ' ' ARG . 92.1 m-20 -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.532 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.579 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.22 -49.19 78.79 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.753 -179.55 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.422 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 50.8 t-20 -64.21 -40.44 96.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.678 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 79' ' ' ARG . 55.6 t -62.0 -45.81 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.773 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.65 -48.85 86.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.318 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.5 -38.56 90.08 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.76 77.27 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.319 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.73 -46.1 83.67 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.288 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.52 ' OH ' HD13 ' A' ' 45' ' ' LEU . 12.8 m-85 -63.85 -27.7 69.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.946 0.403 . . . . 0.0 110.121 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.38 29.37 73.08 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.3 mt -102.3 17.33 23.73 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.878 0.37 . . . . 0.0 110.798 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -57.13 -48.59 78.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.777 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.467 ' O ' ' O ' ' A' ' 93' ' ' LYS . . . 107.02 55.52 0.64 Allowed Glycine 0 CA--C 1.528 0.889 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.467 ' O ' ' O ' ' A' ' 92' ' ' GLY . 98.7 mttt 45.3 -175.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.857 0.36 . . . . 0.0 110.69 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 25.0 pttm -109.08 63.46 0.6 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.956 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.457 ' OD2' ' O ' ' A' ' 97' ' ' ARG . 20.8 t70 -88.88 101.47 14.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.891 0.377 . . . . 0.0 110.658 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.93 -24.3 55.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.846 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.457 ' O ' ' OD2' ' A' ' 95' ' ' ASP . 19.2 ptp180 -80.35 140.73 35.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.678 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -145.71 160.57 41.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.263 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.6 t -115.74 130.55 70.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.1 p -62.93 -50.46 70.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.242 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.8 t -75.66 145.11 41.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.81 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -88.72 80.81 7.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.909 0.385 . . . . 0.0 110.286 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 8.3 t -65.84 -21.12 66.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.688 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.425 HD13 ' C ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER 50.37 89.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.664 179.818 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.2 t -143.62 134.4 25.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.551 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -99.29 -20.38 18.05 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.8 t -147.19 153.23 39.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.893 0.377 . . . . 0.0 110.706 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -162.12 153.99 18.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.347 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.54 ' OE1' ' N ' ' A' ' 109' ' ' GLU . 55.8 mp0 -127.44 141.21 51.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.78 0.324 . . . . 0.0 110.383 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.584 ' CG ' ' H ' ' A' ' 111' ' ' GLY . 10.1 p-10 -60.37 -82.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.651 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.584 ' H ' ' CG ' ' A' ' 110' ' ' ASP . . . 156.4 -98.26 0.17 Allowed Glycine 0 CA--C 1.522 0.501 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.2 tp -148.39 159.51 43.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.791 0.329 . . . . 0.0 110.743 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 46.0 p30 -115.35 12.51 16.38 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.018 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 5.3 m-20 -107.04 117.89 55.35 Favored Pre-proline 0 N--CA 1.466 0.369 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.698 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -66.9 -30.21 40.32 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.077 1.852 . . . . 0.0 112.537 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -68.17 -45.29 73.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.722 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 58.2 mt -82.7 -28.09 30.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.882 0.372 . . . . 0.0 110.644 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 77.9 mt-10 -60.48 -25.2 65.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.937 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.49 -55.76 29.53 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.52 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 120' ' ' LEU . 32.1 mt -68.96 -42.33 76.76 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 112.112 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.64 ' CE3' HD22 ' A' ' 135' ' ' LEU . 7.5 t-105 -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.739 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.593 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.4 m-70 -68.0 -32.92 73.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.054 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.464 ' O ' ' CB ' ' A' ' 127' ' ' SER . 13.1 tptt -57.52 -49.56 75.93 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.96 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -69.15 -47.41 65.09 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.654 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.455 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 37.3 ttmt -54.6 -50.72 67.38 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.649 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 54.7 m -74.31 -41.9 60.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.932 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.3 t -48.62 -26.15 2.11 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 -178.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.67 -94.22 0.1 OUTLIER Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.041 -1.076 . . . . 0.0 111.515 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.4 pttm -162.83 30.97 0.1 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.515 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 6.5 m-85 -64.31 49.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.233 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.576 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.6 p -104.5 137.4 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.197 0.522 . . . . 0.0 111.767 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 95.45 -97.34 2.1 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-N 115.234 -0.893 . . . . 0.0 112.218 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 97.9 mt-10 -78.14 -43.91 27.49 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.8 0.333 . . . . 0.0 111.679 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 138' ' ' LEU . 48.2 mt-10 -60.61 -52.52 64.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.054 0.454 . . . . 0.0 110.197 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.64 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -62.05 -41.44 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.938 179.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -61.3 -37.97 85.15 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 56.1 mmtt -62.03 -42.41 99.15 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 134' ' ' GLU . 9.1 mp -59.73 -42.56 93.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -36.94 85.96 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.569 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 72.5 mtp85 -54.1 -42.13 69.06 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 118.588 -1.245 . . . . 0.0 108.149 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -69.23 -41.62 76.76 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.678 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -57.23 -57.57 12.02 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.583 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.56 -39.14 83.05 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.179 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.569 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 2.0 m-70 -54.61 -43.16 71.96 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.416 -0.514 . . . . 0.0 109.846 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.62 -39.13 88.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.574 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -59.75 -46.3 89.57 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.192 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 10.2 pt-20 -69.89 -44.82 68.97 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.419 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 86.1 mttt -62.92 -46.7 86.58 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.233 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.444 HG22 HD13 ' A' ' 197' ' ' ILE . 55.1 t -64.49 -44.27 96.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.397 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.733 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.4 m170 -60.87 -38.54 85.98 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.465 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -61.49 -44.75 96.53 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.992 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.557 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 31.3 m-85 -66.74 -49.67 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.381 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -65.66 -41.03 93.01 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.953 0.406 . . . . 0.0 111.164 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 150' ' ' HIS . 66.9 t -63.57 -44.54 98.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.727 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.2 mt -63.41 -44.89 93.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.511 179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 20.6 mt -63.9 -42.59 97.39 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.692 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' GLU . . . . . 0.477 ' O ' ' OG ' ' A' ' 160' ' ' SER . 76.3 mm-40 -67.32 -29.89 69.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.098 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 62.6 m -67.79 -48.24 66.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.568 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 2.7 pp -78.82 -21.84 47.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.823 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.477 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 79.0 p -60.44 -35.94 77.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.715 -179.401 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -64.18 -42.5 96.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.12 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.656 ' C ' ' H ' ' A' ' 164' ' ' GLU . 12.6 p -81.54 178.47 8.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.384 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 65.19 -30.06 0.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.998 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.656 ' H ' ' C ' ' A' ' 162' ' ' THR . 96.1 mt-10 -105.54 55.53 0.69 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.023 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.531 ' O ' HG23 ' A' ' 165' ' ' ILE . 11.2 tp -134.76 126.61 47.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.546 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 45.6 m170 44.63 24.71 0.11 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.115 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.406 ' N ' ' C ' ' A' ' 165' ' ' ILE . 47.5 tp10 -95.45 116.29 28.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.495 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.404 ' OD1' ' O ' ' A' ' 167' ' ' GLU . 92.0 m-20 -147.88 64.33 1.11 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.541 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.97 133.22 64.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.49 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.2 tt -131.48 136.11 58.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.572 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -135.36 160.05 69.43 Favored Pre-proline 0 C--O 1.232 0.166 0 CA-C-O 120.806 0.336 . . . . 0.0 110.203 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -69.26 84.94 0.56 Allowed 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.654 2.236 . . . . 0.0 112.182 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 8.1 m -153.15 145.88 24.32 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.436 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -59.96 -49.14 78.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.907 0.384 . . . . 0.0 110.085 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.606 ' O ' ' N ' ' A' ' 177' ' ' ASP . 20.0 mt -122.99 111.01 16.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.955 179.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 27.6 t 44.59 -85.15 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.586 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.606 ' N ' ' O ' ' A' ' 175' ' ' LEU . 28.1 t70 -158.95 49.75 0.35 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.725 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.456 HD11 ' CB ' ' A' ' 175' ' ' LEU . 1.8 pt -127.1 160.26 36.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.572 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -87.82 -6.75 57.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.487 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 106.34 48.0 1.02 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 50.2 m -123.69 2.35 8.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.569 0.223 . . . . 0.0 110.943 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 1.018 HG12 ' H ' ' A' ' 183' ' ' LEU . 4.2 t -143.83 -167.52 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.736 0.303 . . . . 0.0 110.514 -179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 1.018 ' H ' HG12 ' A' ' 182' ' ' VAL . 2.0 mt 62.26 -30.41 0.08 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.915 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.636 ' H ' ' C ' ' A' ' 182' ' ' VAL . 29.7 p80 -58.24 -45.32 87.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.644 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.594 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 78.2 p -62.6 -41.77 99.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.398 -179.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -61.97 -45.25 94.47 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.099 0.476 . . . . 0.0 110.867 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 187' ' ' HIS . . . . . 0.759 ' NE2' HD22 ' A' ' 183' ' ' LEU . 27.6 m-70 -66.41 -37.6 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.059 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 57.8 m -60.87 -44.02 97.63 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.209 -0.451 . . . . 0.0 109.913 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -62.64 -38.35 89.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.018 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 3.4 mt -62.17 -39.79 93.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.156 179.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -66.64 -42.47 86.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.007 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -68.69 -35.79 77.66 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.567 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.557 ' HE3' ' CD1' ' A' ' 152' ' ' TYR . 26.9 mtpt -63.34 -46.95 84.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.696 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -72.24 -35.77 68.91 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.286 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.451 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 11.0 mmt85 -64.29 -41.36 96.91 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.626 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 69.8 m -65.47 -45.22 84.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.229 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.444 HD13 HG22 ' A' ' 149' ' ' VAL . 90.7 mt -66.33 -44.31 91.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.176 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -65.73 -40.83 92.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.029 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 195' ' ' ARG . 79.3 mt-30 -64.32 -36.68 84.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.23 178.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.98 -51.83 50.04 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 31.0 mt -64.29 -41.63 96.78 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.222 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -63.58 -36.6 84.34 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.71 ' HE ' HG21 ' A' ' 207' ' ' VAL . 0.0 OUTLIER -63.16 -44.16 96.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.72 179.101 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 33.3 mt -62.02 -39.03 90.91 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -61.93 -45.6 92.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.968 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.69 ' O ' ' N ' ' A' ' 210' ' ' GLN . 90.3 mmt-85 -65.76 -42.35 90.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.092 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.71 HG21 ' HE ' ' A' ' 203' ' ' ARG . 77.0 t -64.09 -45.36 96.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.061 0.457 . . . . 0.0 110.319 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -67.47 -28.85 68.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.659 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -101.21 -14.11 17.84 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.712 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.69 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.1 tt0 -140.15 -20.32 0.87 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.619 0.247 . . . . 0.0 111.361 -179.031 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.682 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -78.31 23.35 2.82 Favored Glycine 0 N--CA 1.461 0.339 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.598 ' CG ' ' N ' ' A' ' 213' ' ' SER . 71.7 t80 -52.26 175.45 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.611 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.598 ' N ' ' CG ' ' A' ' 212' ' ' TYR . 29.4 t -56.27 132.77 51.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.018 -179.07 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.617 HG22 ' N ' ' A' ' 215' ' ' GLU . 90.4 m -148.2 164.81 32.83 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.772 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.617 ' N ' HG22 ' A' ' 214' ' ' THR . 5.4 pt-20 -128.35 101.92 6.43 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.143 -0.481 . . . . 0.0 109.875 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 216' ' ' ALA . . . . . 0.509 ' C ' ' H ' ' A' ' 218' ' ' PHE . . . 178.15 -79.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.629 -179.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 64.13 -15.37 0.08 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.006 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.509 ' H ' ' C ' ' A' ' 216' ' ' ALA . 51.6 m-85 -147.57 -50.23 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.35 -0.54 . . . . 0.0 112.291 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 220' ' ' GLU . 82.0 tt0 -62.99 -105.96 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.815 -179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 219' ' ' GLU . 2.8 mt-10 55.36 153.59 0.06 OUTLIER Pre-proline 0 N--CA 1.472 0.64 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.675 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -83.12 81.79 2.28 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 122.201 1.934 . . . . 0.0 112.07 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -147.28 -98.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.968 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.552 HG13 ' N ' ' A' ' 224' ' ' ILE . 7.5 p -60.52 -46.04 96.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.659 0 CA-C-O 121.154 0.502 . . . . 0.0 110.801 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.754 HD11 ' CE1' ' A' ' 250' ' ' PHE . 0.7 OUTLIER -63.41 -35.64 73.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.818 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -62.09 -41.87 98.63 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.067 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 9.6 mt -59.39 -40.58 87.01 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.614 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 46.6 m0 -60.48 -43.98 96.39 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.04 178.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.624 HD23 ' OG ' ' A' ' 232' ' ' SER . 3.6 mt -68.9 -43.82 74.45 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.331 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -39.64 -37.68 0.53 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.396 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -70.17 -45.87 65.84 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.173 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.624 ' OG ' HD23 ' A' ' 229' ' ' LEU . 91.6 p -80.11 -6.88 58.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.394 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -67.26 -121.28 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.376 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 234' ' ' ASN . . . . . 0.521 ' C ' HD22 ' A' ' 235' ' ' LEU . 0.2 OUTLIER -163.38 69.58 0.22 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 110.544 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.546 ' N ' HD22 ' A' ' 235' ' ' LEU . 3.4 mm? -100.76 -171.91 2.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.711 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 10.9 p -82.97 163.15 21.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.699 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -63.79 -46.89 83.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.892 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.51 -43.13 95.06 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.556 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.525 ' OE1' ' N ' ' A' ' 323' ' ' LEU . 47.2 tp10 -63.74 -36.29 83.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.638 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -61.79 -45.31 94.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.384 -179.615 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -64.24 -47.49 79.46 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.89 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.56 -41.98 99.25 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.816 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.498 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.23 -43.95 93.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.437 178.904 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -47.5 85.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.211 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.91 -46.97 79.45 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.354 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -56.44 -53.13 61.0 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.292 0.568 . . . . 0.0 110.382 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.03 -40.3 97.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.573 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 64.1 tttp -50.47 -45.46 56.21 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.76 -41.83 91.6 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.221 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 250' ' ' PHE . . . . . 0.754 ' CE1' HD11 ' A' ' 224' ' ' ILE . 0.0 OUTLIER -58.64 -51.45 69.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.447 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.551 ' N ' ' CG ' ' A' ' 250' ' ' PHE . 11.6 pt-20 -59.59 -37.5 78.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.04 95.77 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.525 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.3 -46.22 87.73 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.41 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -64.64 -38.7 83.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -60.34 -44.91 95.09 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.515 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -61.63 -43.91 97.98 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 257' ' ' HIS . . . . . 0.532 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -55.95 -43.97 77.99 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.539 -0.464 . . . . 0.0 109.78 179.226 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 258' ' ' ASN . . . . . 0.532 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 39.9 t-20 -59.92 -41.16 91.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.237 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -59.0 -47.95 83.37 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.905 0.384 . . . . 0.0 110.296 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -61.8 -37.59 84.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.303 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -59.16 -43.84 92.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.307 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -61.61 -47.76 83.98 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.13 0.49 . . . . 0.0 110.041 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -64.27 -35.06 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.03 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 65.3 tp -62.04 -42.99 99.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.201 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.21 -46.2 88.11 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.456 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.13 -43.63 98.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.164 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.55 78.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.251 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 268' ' ' HIS . . . . . 0.53 ' NE2' ' NE ' ' A' ' 272' ' ' ARG . 24.7 t60 -64.05 -46.1 85.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.318 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.95 -46.15 91.86 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 110.389 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.47 -39.41 90.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.356 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.697 HD23 ' O ' ' A' ' 271' ' ' LEU . 2.6 tt -60.42 -44.59 95.61 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 272' ' ' ARG . . . . . 0.53 ' NE ' ' NE2' ' A' ' 268' ' ' HIS . 99.8 mtt180 -60.33 -44.17 95.75 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.21 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -67.77 -39.62 84.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.656 -0.417 . . . . 0.0 110.83 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.557 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -60.59 -36.81 79.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.007 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.61 -24.5 63.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 0.0 110.364 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 9.0 t -88.32 3.46 49.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.868 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.592 HG13 ' N ' ' A' ' 278' ' ' GLY . 11.3 p -61.11 -44.94 99.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.592 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 149.41 -98.44 0.19 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.72 -37.95 89.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.833 0.349 . . . . 0.0 110.164 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.14 46.75 8.93 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -68.72 -32.77 72.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.741 0.305 . . . . 0.0 110.755 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 282' ' ' ARG . . . . . 0.441 HH11 ' CB ' ' A' ' 274' ' ' ALA . 9.4 ptm180 -91.07 0.96 57.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.995 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 39.2 t -61.49 -46.33 96.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.7 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.5 t -61.74 -44.78 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.139 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 53.1 ttt85 -62.68 -46.8 86.48 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.952 0.406 . . . . 0.0 110.924 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.1 t -63.22 -45.07 93.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -63.9 -39.79 94.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -58.76 -59.58 5.2 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.019 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.602 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.7 mmtp -64.02 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.866 -0.734 . . . . 0.0 110.044 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -46.19 -54.65 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.897 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.34 82.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.714 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.602 HD23 ' HD3' ' A' ' 289' ' ' LYS . 18.5 tp -59.77 -49.92 75.85 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.809 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.65 -42.0 98.16 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.38 0.61 . . . . 0.0 109.827 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.484 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.9 tt0 -62.91 -36.62 83.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.802 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.96 -42.86 98.13 Favored Glycine 0 CA--C 1.522 0.492 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.2 tpp85 -60.33 -44.47 95.47 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.08 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 35.2 p -58.87 -46.76 87.01 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.436 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -62.5 -45.07 94.7 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.05 0.453 . . . . 0.0 110.338 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -59.5 -39.99 85.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.71 -43.01 99.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.17 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.22 -42.15 97.09 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 302' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 61.5 t80 -61.93 -45.53 93.28 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.389 0.614 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 9.8 m -59.75 -42.58 93.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.763 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.74 -42.91 90.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -54.9 -52.17 63.75 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.571 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 306' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 50.1 mttt -62.46 -40.5 96.82 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.93 -0.708 . . . . 0.0 110.996 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -64.46 -36.32 83.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.188 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.614 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 12.4 mt -62.51 -43.74 98.08 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.448 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -66.94 -44.72 79.91 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.672 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -64.41 -48.55 74.97 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.405 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.459 HD12 ' CH2' ' A' ' 227' ' ' TRP . 31.8 mt -63.29 -41.73 99.01 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.523 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 11.5 t -61.0 -43.33 99.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.446 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.21 -51.8 52.23 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 120.931 -0.652 . . . . 0.0 111.682 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -67.2 -41.85 85.12 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.218 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 5.0 mm -63.76 -41.73 93.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.1 p -58.88 -41.22 86.61 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.502 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.439 ' O ' ' HB3' ' A' ' 318' ' ' ALA . 10.4 tpp180 -76.27 -70.13 0.46 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 117.814 -1.555 . . . . 0.0 108.146 176.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.608 ' HA ' HD11 ' A' ' 323' ' ' LEU . . . 69.01 89.6 0.1 Allowed 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 113.727 -1.578 . . . . 0.0 107.372 -178.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 77.2 mtp85 -69.47 150.23 47.42 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -176.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -69.28 -28.67 66.49 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.915 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -89.86 15.7 9.4 Favored 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 81.78 128.74 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.608 HD11 ' HA ' ' A' ' 318' ' ' ALA . 94.0 mt . . . . . 0 C--O 1.221 -0.427 0 CA-C-N 113.571 -1.649 . . . . 0.0 111.215 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m 56.37 84.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.014 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 68.5 ttp85 -81.11 140.45 35.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.115 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -49.74 154.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.458 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -127.04 140.54 52.22 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.648 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.445 ' O ' ' CB ' ' A' ' 7' ' ' GLN . 28.7 t-20 -173.78 165.11 4.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.314 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.445 ' CB ' ' O ' ' A' ' 6' ' ' ASN . 3.5 tp60 76.91 90.21 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.833 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -82.0 156.56 17.74 Favored 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 123.018 2.479 . . . . 0.0 112.34 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.794 ' H ' ' CD ' ' A' ' 10' ' ' PRO . 19.9 ttpt -122.52 -38.31 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.413 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.575 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.794 ' CD ' ' H ' ' A' ' 9' ' ' LYS . 26.0 Cg_exo -62.43 147.9 94.15 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.576 2.184 . . . . 0.0 112.238 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.3 p 173.21 67.58 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.613 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.589 ' O ' ' N ' ' A' ' 14' ' ' ARG . 73.4 Cg_endo -74.98 146.59 32.93 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.787 2.325 . . . . 0.0 111.697 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.544 ' C ' ' O ' ' A' ' 12' ' ' PRO . 68.1 tttt 23.29 -86.62 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.333 0.396 . . . . 0.0 110.769 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.589 ' N ' ' O ' ' A' ' 12' ' ' PRO . 84.8 mtt85 -114.54 167.32 10.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.303 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -79.25 -127.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.785 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -160.25 167.41 27.63 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.433 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -153.6 165.19 31.4 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -130.99 143.36 50.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.833 0.349 . . . . 0.0 110.87 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -69.61 -35.3 75.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.575 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 -130.62 157.82 41.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.781 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.679 ' NH2' ' OE2' ' A' ' 53' ' ' GLU . 89.3 mtm-85 -95.85 12.37 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.018 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.448 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 1.2 mpt? -138.03 141.39 40.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.035 0.445 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 20.2 pt-20 -65.48 -43.72 89.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.424 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 14.0 pttm -55.66 -44.62 77.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.2 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 22' ' ' MET . 95.7 mt -62.85 -42.38 99.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.025 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -62.93 -41.69 99.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.377 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -60.02 -45.42 92.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.572 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 28' ' ' LEU . 92.4 mt -61.89 -42.57 99.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.254 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 27.7 t-105 -62.58 -45.96 90.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.384 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -57.54 -43.49 84.45 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.252 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.24 -43.05 99.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.591 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.09 80.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.942 0.401 . . . . 0.0 110.342 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.432 ' O ' ' ND1' ' A' ' 36' ' ' HIS . 76.3 mt-30 -61.65 -38.66 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.349 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.459 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 60.1 ttm-85 -60.57 -42.16 96.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.384 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.0 mt -69.55 -30.15 67.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.732 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.459 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 68.0 m-70 65.99 118.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.743 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -138.07 154.46 74.21 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.859 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.31 154.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 122.718 2.279 . . . . 0.0 112.364 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.67 -48.7 0.38 Allowed 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.617 2.211 . . . . 0.0 112.403 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.543 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 71.7 t -61.67 -48.65 87.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.435 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.7 ttp85 -65.04 -41.67 94.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.402 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.47 -42.4 99.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.619 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.82 88.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.414 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.543 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 3.7 mp0 -67.91 -41.22 83.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.652 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.7 tp -61.84 -48.33 81.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.154 0.502 . . . . 0.0 110.622 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.2 -41.44 96.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.604 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -57.92 -48.61 79.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.603 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -55.75 -48.97 74.34 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.94 0.4 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.9 mt -58.25 -39.78 80.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.153 0.501 . . . . 0.0 109.833 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.81 -38.42 85.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.604 HG12 ' O ' ' A' ' 47' ' ' ALA . 37.2 mm -62.3 -42.57 95.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.671 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -57.38 -50.85 71.67 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.471 179.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.679 ' OE2' ' NH2' ' A' ' 21' ' ' ARG . 82.2 tt0 -55.24 -49.25 72.49 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.444 0.64 . . . . 0.0 110.296 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -60.73 -42.74 97.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.314 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -62.02 -38.24 87.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.4 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.45 -49.23 76.93 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.89 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 14.8 mt -61.32 -42.25 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.456 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -41.78 97.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.49 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -60.67 -41.42 95.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.291 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -58.88 -46.01 88.84 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -59.53 -43.29 93.5 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.85 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.05 -37.51 87.47 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.009 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -57.55 -45.6 84.92 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt -61.9 -41.25 97.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.867 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -70.28 -22.09 62.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.314 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.02 38.16 64.01 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 93.4 mt -99.18 -9.44 23.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.758 0.313 . . . . 0.0 110.789 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.46 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 26.7 p-10 -67.36 138.78 57.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.422 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -60.44 -81.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.613 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.411 ' O ' ' OD1' ' A' ' 70' ' ' ASP . 52.2 t0 -154.67 45.92 0.54 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.51 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 83.01 10.8 82.37 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -70.28 -35.27 73.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.856 0.36 . . . . 0.0 110.332 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -64.75 -52.28 57.81 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.129 0.49 . . . . 0.0 110.583 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 22.4 pt-20 -62.65 -38.94 92.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.979 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.47 -42.31 91.73 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.323 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.8 ttt-85 -63.64 -43.52 96.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -63.73 -42.98 97.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.366 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.82 -44.47 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.192 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.604 ' O ' HG23 ' A' ' 83' ' ' VAL . 3.3 mmp_? -59.83 -42.03 92.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.256 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 84' ' ' ILE . 92.6 m-20 -63.57 -39.85 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.294 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.637 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.83 -48.15 82.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.277 0.561 . . . . 0.0 110.171 -179.491 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.77 -38.16 88.3 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.412 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 79' ' ' ARG . 53.6 t -63.71 -46.24 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.424 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.9 mt -59.67 -51.32 74.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.473 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.31 -42.47 92.99 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.062 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.51 99.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.809 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -62.83 -49.22 75.76 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.564 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -67.6 -27.76 67.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.032 179.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 72.97 25.51 73.53 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 90' ' ' LEU . 50.0 mt -91.86 -1.67 57.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.248 . . . . 0.0 110.75 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -61.53 -46.31 90.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.444 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 149.51 170.09 16.65 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.525 ' CG ' ' N ' ' A' ' 94' ' ' LYS . 20.1 ptmt -100.49 -49.11 4.32 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.726 0.298 . . . . 0.0 110.427 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.525 ' N ' ' CG ' ' A' ' 93' ' ' LYS . 10.7 ttmm -148.57 124.26 10.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.617 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.517 ' N ' ' OD1' ' A' ' 95' ' ' ASP . 14.8 p-10 -178.72 103.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.79 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 97' ' ' ARG . . . -65.88 -41.08 92.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.895 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.473 ' O ' ' O ' ' A' ' 96' ' ' ALA . 55.1 ttp180 44.8 100.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.609 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 58.14 -171.49 0.1 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.432 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.598 HG22 ' N ' ' A' ' 100' ' ' THR . 4.1 p -134.23 163.51 36.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.517 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.598 ' N ' HG22 ' A' ' 99' ' ' VAL . 53.9 p -45.73 168.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.609 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 25.9 t -48.27 105.48 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.817 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -64.72 -41.16 96.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.604 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.0 t 56.5 78.54 0.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.587 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.671 ' O ' HD13 ' A' ' 104' ' ' LEU . 0.3 OUTLIER -62.06 -45.39 93.77 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 59.5 m -138.43 -38.01 0.54 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.493 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 144.63 -56.09 0.54 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 45.11 71.25 0.28 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.874 0.369 . . . . 0.0 110.593 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -124.88 123.09 39.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.613 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.443 ' OE1' ' N ' ' A' ' 109' ' ' GLU . 53.8 mp0 -79.11 120.79 24.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.036 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 109' ' ' GLU . 87.5 m-20 -135.24 148.92 49.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.56 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -147.83 -106.97 0.45 Allowed Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.3 mt -112.11 132.72 54.69 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -128.83 -57.13 1.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.398 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.52 136.53 71.34 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.636 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.06 -36.71 66.54 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 122.527 2.151 . . . . 0.0 112.302 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.443 HH11 ' HD2' ' A' ' 116' ' ' ARG . 52.1 mtm180 -60.35 -44.8 95.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.692 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.24 -40.26 95.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.013 0.435 . . . . 0.0 110.572 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -61.6 -39.41 91.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.573 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.6 mtmt -61.06 -42.4 98.42 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.409 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.49 -48.02 79.37 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.273 0.559 . . . . 0.0 111.88 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.558 ' CE3' HD22 ' A' ' 135' ' ' LEU . 19.1 t-105 -61.98 -48.42 80.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.426 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 3.2 m80 -69.26 -29.92 67.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.335 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.626 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.5 tptt -58.58 -52.01 67.48 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.894 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.26 -46.46 49.82 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.433 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 46.4 tttt -52.0 -47.43 64.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.669 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.2 m -82.87 -43.98 15.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.863 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.567 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 20.6 m -44.53 -28.92 0.64 Allowed 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.155 -178.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -158.29 -96.84 0.12 Allowed Glycine 0 N--CA 1.46 0.284 0 C-N-CA 119.626 -1.273 . . . . 0.0 111.356 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.63 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.7 mttt -155.98 21.3 0.38 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.796 ' HA ' ' HG3' ' A' ' 134' ' ' GLU . 2.9 m-85 -62.45 49.44 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.907 -178.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.63 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.0 OUTLIER -112.39 110.77 21.17 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.378 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 133.31 -98.8 0.35 Allowed Glycine 0 CA--C 1.53 0.988 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.816 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.2 mm-40 -81.85 -44.05 17.41 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.495 -0.415 . . . . 0.0 111.31 -179.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.948 ' CD ' ' H ' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -63.73 -46.11 86.85 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.558 HD22 ' CE3' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -62.44 -41.9 99.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.097 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -62.98 -37.1 85.79 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.468 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 59.3 mttp -61.69 -43.11 99.49 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.324 0.583 . . . . 0.0 109.839 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 134' ' ' GLU . 2.7 mm? -59.47 -43.68 93.18 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.95 -37.38 87.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.619 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -51.38 -42.07 61.12 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.584 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 6.0 mp0 -68.55 -45.47 72.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.374 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -56.6 -52.74 63.69 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.357 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.59 -39.94 89.94 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.238 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -55.5 -40.87 72.29 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.481 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.412 ' CE1' HG23 ' A' ' 197' ' ' ILE . 4.2 m-70 -64.97 -41.72 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.786 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -60.19 -48.89 79.81 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.763 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 18.5 pt-20 -70.93 -46.28 62.73 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.512 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 68.1 mttm -61.57 -43.2 99.3 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.542 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 43.4 t -64.65 -43.84 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.731 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.752 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -62.7 -36.18 82.13 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.452 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 147' ' ' GLU . 79.4 mm-40 -65.04 -48.04 75.25 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.55 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -67.96 -42.17 81.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.933 0.397 . . . . 0.0 110.432 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 58.3 m-20 -69.45 -45.87 68.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.015 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.752 HG23 ' O ' ' A' ' 150' ' ' HIS . 71.6 t -62.71 -46.47 96.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.064 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 26.3 mt -63.7 -43.97 95.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.575 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.439 ' O ' ' OG ' ' A' ' 160' ' ' SER . 31.9 mt -63.98 -43.45 95.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.605 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 157' ' ' GLU . . . . . 0.615 ' OE1' ' N ' ' A' ' 157' ' ' GLU . 0.3 OUTLIER -67.42 -29.47 68.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 109.882 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 59.0 m -66.38 -52.18 49.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.006 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 2.9 pp -79.85 -22.06 43.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.944 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 31.2 m -72.35 -20.09 61.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.976 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.539 ' CG ' ' N ' ' A' ' 162' ' ' THR . 35.0 ptt180 -58.08 -46.77 84.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.161 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.539 ' N ' ' CG ' ' A' ' 161' ' ' ARG . 1.1 p -102.69 24.38 10.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.937 0.399 . . . . 0.0 110.537 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -117.87 -10.76 10.39 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.709 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 74.9 tt0 -112.1 35.17 3.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.77 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.576 ' O ' ' ND1' ' A' ' 166' ' ' HIS . 3.8 tp -134.8 129.33 51.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.833 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.576 ' ND1' ' O ' ' A' ' 165' ' ' ILE . 12.2 m80 -168.25 25.0 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.331 0.586 . . . . 0.0 109.43 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 45.24 24.04 0.13 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.549 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.551 ' ND2' ' O ' ' A' ' 166' ' ' HIS . 0.4 OUTLIER 173.98 110.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.548 179.544 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 169' ' ' VAL . . . . . 0.412 ' O ' ' HB ' ' A' ' 170' ' ' ILE . 56.9 t -139.99 91.14 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.808 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.693 HG23 ' O ' ' A' ' 170' ' ' ILE . 16.2 tt 177.41 98.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.753 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -162.16 156.8 19.17 Favored Pre-proline 0 N--CA 1.454 -0.253 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.212 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.9 108.76 2.79 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.527 2.152 . . . . 0.0 111.97 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.673 ' OG ' ' N ' ' A' ' 177' ' ' ASP . 2.3 t -154.42 135.19 13.65 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.597 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -65.51 -43.38 90.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.46 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.429 HD23 ' C ' ' A' ' 175' ' ' LEU . 2.4 tt -152.5 79.2 1.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.067 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 177' ' ' ASP . 43.9 p 48.02 37.54 7.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.524 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.673 ' N ' ' OG ' ' A' ' 173' ' ' SER . 37.5 t70 58.63 133.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.514 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 11.3 mm -99.79 126.18 53.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.394 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 4.7 tttp -164.51 21.56 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.586 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.51 ' O ' ' O ' ' A' ' 181' ' ' SER . . . 113.96 -138.07 14.6 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.51 ' O ' ' O ' ' A' ' 180' ' ' GLY . 8.7 p 46.86 103.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.875 0.369 . . . . 0.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.46 ' O ' ' HG ' ' A' ' 183' ' ' LEU . 2.5 t -58.93 138.58 19.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.353 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 182' ' ' VAL . 1.6 mt -179.05 -12.76 0.0 OUTLIER 'General case' 0 C--O 1.242 0.662 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.821 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.437 ' ND1' ' N ' ' A' ' 184' ' ' HIS . 2.4 m-70 -58.5 -41.03 84.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.996 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 89.7 p -59.96 -42.89 95.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.817 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.513 ' O ' HD13 ' A' ' 190' ' ' LEU . 42.0 ttm180 -60.9 -45.37 94.88 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.546 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -59.9 -39.61 85.98 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.082 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 58.9 m -61.48 -43.76 98.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.197 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -57.88 -42.11 83.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.971 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.513 HD13 ' O ' ' A' ' 186' ' ' ARG . 10.6 mp -62.27 -45.08 94.87 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.597 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.487 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.11 -39.16 82.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.094 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 5.2 tm-20 -67.97 -46.05 72.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.084 0.469 . . . . 0.0 111.638 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 17.6 pttt -74.6 -44.5 50.39 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.325 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.695 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -67.15 -41.01 86.77 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.939 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.541 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -67.27 -35.58 79.79 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.62 ' O ' ' HG3' ' A' ' 199' ' ' GLN . 73.8 m -62.25 -40.74 97.18 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.412 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.5 mt -66.7 -44.26 89.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.357 0.599 . . . . 0.0 109.723 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 46.9 m-20 -64.18 -47.46 79.74 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.436 0.636 . . . . 0.0 110.389 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.62 ' HG3' ' O ' ' A' ' 196' ' ' SER . 0.0 OUTLIER -64.58 -29.62 70.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.052 179.514 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -64.6 -43.56 96.29 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 201' ' ' LEU . 28.2 mt -63.6 -41.88 98.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.045 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.523 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.23 -36.21 83.35 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.368 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.4 -41.86 99.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.508 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.9 mt -61.43 -40.54 94.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.294 179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -63.45 -41.13 98.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.959 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.719 ' O ' ' N ' ' A' ' 210' ' ' GLN . 78.9 mtp85 -64.13 -38.94 92.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.288 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.588 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -64.17 -43.11 97.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.024 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.0 p -62.97 -37.31 86.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.683 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 24.1 m170 -94.61 -38.46 10.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.379 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.719 ' N ' ' O ' ' A' ' 206' ' ' ARG . 39.6 tt0 -93.89 -32.97 13.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.739 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.588 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -88.84 28.04 6.83 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -59.03 -49.44 77.88 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.69 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.446 ' O ' ' O ' ' A' ' 214' ' ' THR . 1.3 t -178.62 108.62 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.478 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.475 ' O ' ' OE1' ' A' ' 215' ' ' GLU . 7.0 p 52.36 108.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.245 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.478 ' HG3' ' H ' ' A' ' 216' ' ' ALA . 5.8 tp10 -167.42 -166.84 0.82 Allowed 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.171 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 216' ' ' ALA . . . . . 0.478 ' H ' ' HG3' ' A' ' 215' ' ' GLU . . . 62.59 62.07 1.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.722 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.646 ' O ' ' N ' ' A' ' 219' ' ' GLU . 79.5 mm-40 -147.98 36.96 0.86 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.317 -179.255 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -42.69 82.73 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 120.598 0.237 . . . . 0.0 110.623 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' A' ' 217' ' ' GLU . 6.1 pt-20 172.36 -25.65 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.765 179.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 221' ' ' PRO . 0.5 OUTLIER -59.31 178.67 0.22 Allowed Pre-proline 0 N--CA 1.466 0.353 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.619 -179.315 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 220' ' ' GLU . 59.3 Cg_endo -84.11 88.42 1.06 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.597 2.198 . . . . 0.0 112.801 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -141.25 -105.65 0.15 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.441 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.553 HG13 ' N ' ' A' ' 224' ' ' ILE . 14.9 p -61.74 -46.6 96.17 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 CA-C-O 121.79 0.805 . . . . 0.0 110.046 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.553 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.2 OUTLIER -61.56 -32.86 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.672 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 225' ' ' ASP . . . . . 0.551 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 56.1 t0 -64.25 -40.56 96.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.541 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.6 tp -56.04 -42.42 76.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.456 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 27.5 m0 -62.65 -33.92 76.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.736 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 228' ' ' ASP . . . . . 0.65 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 92.7 m-20 -59.31 -39.12 82.06 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.623 ' N ' HD22 ' A' ' 229' ' ' LEU . 4.1 mm? -65.67 -40.27 92.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.725 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.597 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -25.42 -66.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.301 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.65 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 0.3 OUTLIER -25.48 -87.48 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.726 179.862 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 58.9 m -79.26 45.95 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.738 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 233' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -139.51 81.59 1.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.835 0.35 . . . . 0.0 110.54 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 60.38 59.54 2.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.374 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.597 HD12 ' O ' ' A' ' 230' ' ' ALA . 76.8 mt -141.13 157.57 45.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.997 0.427 . . . . 0.0 110.783 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 74.8 p -83.34 -162.35 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.674 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 237' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 34.9 p-10 -91.75 -53.72 4.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.101 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 63.8 mttp -61.02 -45.59 94.18 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.25 0.547 . . . . 0.0 110.689 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -62.16 -27.17 68.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.556 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.1 OUTLIER -64.26 -46.1 85.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.589 -179.371 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -66.99 -44.05 81.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.363 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -57.96 -51.1 71.06 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.337 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.456 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.97 -45.02 95.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.51 179.424 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.4 ttt-85 -51.85 -57.53 9.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.403 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -62.08 -35.54 78.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.675 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.23 -53.02 63.02 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.23 0.538 . . . . 0.0 110.445 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.2 mm? -63.21 -41.42 99.14 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.728 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.56 -37.63 78.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.386 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -65.48 -65.01 0.73 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.493 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 250' ' ' PHE . . . . . 0.565 ' CE2' ' CE1' ' A' ' 307' ' ' HIS . 76.2 m-85 -60.46 -40.75 92.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.701 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.542 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.9 tp10 -57.9 -42.04 83.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.285 0.564 . . . . 0.0 109.883 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.33 -35.75 80.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.236 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -60.88 -47.63 85.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.834 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.46 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.2 tt -65.36 -38.13 81.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.174 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.79 -48.36 80.99 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 121.213 0.53 . . . . 0.0 110.468 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.03 -41.46 99.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.065 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 257' ' ' HIS . . . . . 0.523 ' NE2' ' CD ' ' A' ' 261' ' ' GLN . 0.0 OUTLIER -56.71 -46.16 81.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.955 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 258' ' ' ASN . . . . . 0.501 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 49.7 t30 -60.13 -40.99 91.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.24 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 259' ' ' HIS . . . . . 0.457 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -57.66 -45.08 86.02 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.258 0.552 . . . . 0.0 109.859 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.02 -37.01 85.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.292 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 261' ' ' GLN . . . . . 0.523 ' CD ' ' NE2' ' A' ' 257' ' ' HIS . 82.2 mt-30 -58.23 -44.17 88.12 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.205 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.63 -47.25 86.25 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.115 0.483 . . . . 0.0 109.811 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 263' ' ' GLN . . . . . 0.457 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 5.5 mp0 -65.33 -31.89 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.021 179.377 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.04 -42.52 99.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.108 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 -65.99 -49.02 69.29 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.142 0.496 . . . . 0.0 110.474 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.62 -43.32 98.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.09 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.25 81.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.083 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -61.14 -48.41 81.76 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.25 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.93 -45.07 95.32 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.132 0.491 . . . . 0.0 110.398 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.15 -39.73 91.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.398 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.35 -43.75 96.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.037 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -60.31 -43.5 96.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.079 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -67.88 -40.76 83.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.826 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.33 86.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.948 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -55.84 -22.62 26.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.455 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 17.2 m -61.83 -39.06 90.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.65 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 77.9 t -60.85 -45.47 98.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.605 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 108.84 -6.79 33.14 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 279' ' ' ASP . . . . . 0.555 ' O ' HG23 ' A' ' 283' ' ' VAL . 91.4 m-20 -55.34 99.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.81 0.338 . . . . 0.0 110.496 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.7 -40.24 95.71 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.41 -46.32 89.14 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.729 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -68.94 -41.9 77.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.808 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 283' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 279' ' ' ASP . 54.6 t -64.35 -45.28 96.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 32.4 m -60.69 -45.86 92.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.058 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.86 -43.82 87.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.537 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 42.3 t -62.42 -43.66 98.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.585 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -64.26 -40.21 95.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.694 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -60.53 -51.49 69.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.162 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -66.02 -34.24 77.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.105 179.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -57.39 -52.05 66.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.601 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.67 -38.41 83.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.676 ' O ' HD12 ' A' ' 292' ' ' LEU . 2.2 tp -61.64 -46.91 87.76 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.237 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 293' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 297' ' ' THR . 41.9 tp -64.22 -42.85 96.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.202 0.525 . . . . 0.0 110.102 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.519 ' O ' ' OG1' ' A' ' 297' ' ' THR . 2.3 tm-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.79 -42.47 99.75 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -60.76 -43.54 97.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.473 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.519 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 76.7 p -58.97 -47.18 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.076 0.465 . . . . 0.0 110.358 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -62.35 -44.39 96.58 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.488 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -62.43 -37.5 86.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.022 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -44.18 97.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.983 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.51 96.28 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 302' ' ' TYR . . . . . 0.524 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 51.0 t80 -60.82 -45.83 92.93 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.245 0.545 . . . . 0.0 110.372 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.1 m -61.37 -44.75 96.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.461 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.96 -42.24 88.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.112 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.82 -54.92 40.89 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.058 0.456 . . . . 0.0 110.663 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 306' ' ' LYS . . . . . 0.524 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 75.4 mttt -61.22 -41.35 96.71 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.19 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.565 ' CE1' ' CE2' ' A' ' 250' ' ' PHE . 2.6 t-80 -64.76 -31.17 72.27 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.26 -48.35 81.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.178 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.62 -42.47 86.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.712 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.9 -47.21 85.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.47 HD11 ' CE1' ' A' ' 307' ' ' HIS . 26.8 mt -64.12 -40.51 96.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.74 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.1 t -59.7 -44.68 93.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.11 61.8 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -62.43 -45.6 92.37 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -70.34 -40.52 77.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.133 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.8 t -44.37 -48.08 9.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.055 0.455 . . . . 0.0 110.156 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.473 ' CD ' ' O ' ' A' ' 319' ' ' ARG . 12.5 ptp85 -94.45 -23.84 17.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.036 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 54.66 51.09 14.52 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.473 ' O ' ' CD ' ' A' ' 317' ' ' ARG . 10.7 mtm-85 178.68 104.36 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.246 0.546 . . . . 0.0 111.775 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 320' ' ' HIS . . . . . 0.636 ' N ' HD21 ' A' ' 323' ' ' LEU . 25.0 t-80 -155.18 -40.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.331 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.594 ' CG ' ' H ' ' A' ' 322' ' ' GLU . 15.9 p-10 -150.61 -67.8 0.19 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.433 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.594 ' H ' ' CG ' ' A' ' 321' ' ' ASN . 50.0 mt-10 -132.81 74.37 1.57 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.293 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.636 HD21 ' N ' ' A' ' 320' ' ' HIS . 2.1 pt? . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.135 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 40.8 p90 . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 p -151.92 157.09 41.33 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.534 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -107.81 0.55 22.26 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.622 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -116.24 25.55 10.57 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.792 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -62.22 -40.15 95.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.142 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -66.38 155.38 37.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.304 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.783 ' H ' ' CD ' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -158.6 -41.65 0.0 OUTLIER Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.494 -179.666 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.783 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 25.1 Cg_exo -62.71 145.48 95.02 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 122.835 2.356 . . . . 0.0 112.409 -179.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.2 mtmt -99.09 125.5 41.47 Favored Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.88 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -51.94 -39.63 68.68 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 122.128 1.886 . . . . 0.0 112.222 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.568 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.2 OUTLIER -175.01 -44.28 0.0 OUTLIER Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.604 179.582 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.568 ' CD ' ' N ' ' A' ' 11' ' ' SER . 12.7 Cg_exo -67.09 149.42 82.29 Favored 'Trans proline' 0 N--CA 1.51 2.471 0 C-N-CA 123.199 2.599 . . . . 0.0 113.674 -178.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.49 121.0 29.36 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.853 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -64.54 -43.58 93.54 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.865 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -160.31 173.99 14.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.222 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.4 p -69.35 165.52 20.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.417 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -51.63 178.11 0.07 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.566 ' O ' ' N ' ' A' ' 20' ' ' PHE . 79.6 mm-40 -118.4 142.99 46.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.825 0.345 . . . . 0.0 110.368 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.471 ' OE1' ' OD1' ' A' ' 26' ' ' ASN . 94.2 mt-10 46.1 -84.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.094 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.566 ' N ' ' O ' ' A' ' 18' ' ' GLU . 93.9 m-85 -125.26 177.26 6.23 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.807 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -89.61 10.99 21.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.971 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.3 mmm -142.89 141.39 31.51 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 111.062 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -63.86 -35.6 81.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.39 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -59.69 -47.96 83.56 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.017 0.437 . . . . 0.0 110.458 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.65 -37.88 88.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.47 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.471 ' OD1' ' OE1' ' A' ' 19' ' ' GLU . 48.9 t-20 -63.32 -40.72 98.12 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.347 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.61 -44.27 96.73 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.604 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.91 -42.61 99.29 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.049 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -61.56 -43.66 98.45 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.222 0.534 . . . . 0.0 110.459 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -58.4 -44.52 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.047 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.52 -41.32 97.15 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.523 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.97 87.24 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.055 0.455 . . . . 0.0 110.224 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.42 -38.03 88.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.285 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -60.3 -43.15 96.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.313 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -65.0 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.227 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 66.27 112.13 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.817 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.1 mt -132.43 154.73 81.67 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.798 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -39.41 158.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.396 0 C-N-CA 122.768 2.312 . . . . 0.0 112.264 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -68.72 -46.57 1.7 Allowed 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 122.621 2.214 . . . . 0.0 112.3 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.96 -47.73 91.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.53 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -65.64 -39.2 91.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.349 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.85 -43.65 98.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.712 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -41.54 95.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.421 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -67.17 -45.19 77.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.98 -49.88 72.95 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.157 0.503 . . . . 0.0 110.641 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -60.96 -40.55 93.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.247 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.64 -40.66 92.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.374 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.07 -47.99 83.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.51 -40.31 96.34 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.543 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -58.29 -45.61 87.61 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.154 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -62.99 -42.61 97.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -51.89 -42.42 62.71 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -64.32 -44.52 91.3 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.783 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -61.61 -44.76 96.4 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.44 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -61.27 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.483 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -57.79 -49.14 77.63 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.815 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -61.27 -42.27 98.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.334 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.53 -46.46 88.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.558 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.418 ' CH2' ' HD2' ' A' ' 63' ' ' LYS . 60.8 t90 -57.75 -40.6 80.09 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -58.74 -46.3 87.71 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.939 179.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -60.67 -44.63 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.424 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.409 HD23 ' NZ ' ' A' ' 73' ' ' LYS . 8.1 mp -61.51 -41.47 97.36 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.001 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 87.7 tttt -60.17 -39.27 85.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.683 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.8 tt -61.27 -43.78 98.32 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -71.59 -21.8 61.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.541 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 88.94 15.45 59.34 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 111.291 -0.723 . . . . 0.0 111.291 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.5 mt -63.42 -41.3 98.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.689 0.28 . . . . 0.0 110.767 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.508 ' O ' ' OD1' ' A' ' 68' ' ' ASP . 52.9 p30 -60.53 145.88 46.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.382 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -83.42 -84.98 0.13 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.628 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -115.55 20.8 14.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.97 21.32 50.55 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -57.32 -38.3 73.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.798 0.332 . . . . 0.0 110.278 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.409 ' NZ ' HD23 ' A' ' 62' ' ' LEU . 99.3 mttt -61.35 -45.58 93.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.138 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 tp10 -60.28 -40.28 89.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.004 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.56 91.55 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -62.78 -36.58 83.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.712 HD23 ' C ' ' A' ' 77' ' ' LEU . 7.8 tt -61.78 -47.36 85.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.351 179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -44.85 96.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.269 0.557 . . . . 0.0 109.75 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.56 ' O ' HG23 ' A' ' 83' ' ' VAL . 61.7 ttp180 -57.4 -42.92 83.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.946 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.442 ' O ' HG13 ' A' ' 84' ' ' ILE . 50.4 t30 -62.56 -39.64 94.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.597 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.598 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -58.03 -49.5 76.67 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.765 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -64.0 -39.41 94.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.223 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.1 t -61.49 -45.37 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.454 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.6 mt -59.2 -50.72 78.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.246 -179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.13 -40.9 95.08 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.839 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.63 94.38 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.904 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 47.7 tttp -63.88 -47.94 78.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.629 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.2 -23.3 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.951 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 70.22 27.47 72.8 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt -88.68 -2.23 58.49 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.873 0.368 . . . . 0.0 110.458 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -59.27 -84.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.342 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 125.1 -159.69 19.71 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt 57.45 68.68 0.82 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.816 0.341 . . . . 0.0 110.847 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -63.34 -44.95 93.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.05 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.7 p-10 -167.77 -177.62 3.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.446 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -111.56 129.85 55.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.51 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -167.67 125.04 1.17 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.397 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -150.12 19.97 0.87 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.33 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.7 m -125.49 132.9 70.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.904 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.41 115.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.321 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.1 m -128.58 153.52 47.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.453 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -137.18 129.25 29.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.679 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.0 t -67.15 143.21 56.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.475 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 104' ' ' LEU . 9.7 mp -76.99 149.22 35.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.621 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.3 p 47.3 -84.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.81 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.565 ' N ' ' O ' ' A' ' 104' ' ' LEU . . . 75.22 28.05 62.81 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 20.6 p -97.79 5.8 48.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.792 0.329 . . . . 0.0 110.666 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -63.84 145.23 56.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.649 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -111.15 155.45 22.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.627 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -65.56 -85.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.535 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 144.43 -80.34 0.23 Allowed Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.591 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 14.9 mt -131.64 138.8 48.91 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.815 0.341 . . . . 0.0 111.04 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -91.58 -26.77 18.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.529 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -70.84 123.74 89.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.585 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.83 -24.19 40.62 Favored 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.18 1.92 . . . . 0.0 112.441 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -65.96 -42.93 89.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.626 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.9 mp -85.02 -28.11 25.94 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.8 0.333 . . . . 0.0 110.812 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.591 ' OE2' ' O ' ' A' ' 112' ' ' LEU . 54.2 mt-10 -64.05 -33.94 76.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.978 0.418 . . . . 0.0 110.648 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.591 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 67.9 mmtt -59.79 -46.91 87.74 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.448 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.534 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 31.0 mt -69.09 -47.45 65.2 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.565 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.7 t-105 -59.71 -48.7 80.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.247 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.416 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 2.1 m80 -69.68 -31.16 69.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.207 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.591 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.9 tptt -57.19 -51.19 70.33 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.806 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.38 -47.23 51.04 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 119.453 -0.899 . . . . 0.0 110.744 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.402 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 48.7 tttm -53.33 -51.03 63.72 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.816 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -74.54 -42.68 58.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.358 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -44.41 -27.81 0.48 Allowed 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.28 -96.46 0.11 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 119.609 -1.281 . . . . 0.0 111.506 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.705 ' O ' ' N ' ' A' ' 131' ' ' SER . 57.4 mttp -155.14 24.73 0.42 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.479 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.4 m-30 -59.48 50.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.451 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.705 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.8 m -107.52 113.26 26.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.199 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 120.98 -97.04 0.62 Allowed Glycine 0 CA--C 1.526 0.774 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.828 178.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.491 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 5.6 mp0 -74.41 -43.99 53.87 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.441 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.602 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 51.8 mp0 -63.0 -51.88 65.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.565 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -62.32 -40.26 95.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.935 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -61.66 -41.21 97.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.7 mttt -62.36 -44.05 97.39 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.05 0.452 . . . . 0.0 110.322 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mt -59.53 -43.73 93.38 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.57 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.2 OUTLIER -67.88 -33.82 75.48 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.562 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 71.7 mtp85 -53.93 -45.48 71.25 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 118.866 -1.134 . . . . 0.0 108.131 178.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.51 -37.19 71.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.604 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.57 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.6 m-85 -58.64 -58.16 9.78 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.821 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.97 -41.47 98.05 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.413 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.562 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 48.1 m170 -56.02 -42.62 76.76 Favored 'General case' 0 N--CA 1.46 0.065 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.678 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.831 ' O ' HG22 ' A' ' 149' ' ' VAL . 5.2 m80 -65.82 -39.99 91.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.787 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -59.43 -45.29 91.97 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.257 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -71.54 -46.86 58.38 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.625 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 68.2 mttm -62.69 -46.04 89.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.751 0.31 . . . . 0.0 111.282 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.831 HG22 ' O ' ' A' ' 145' ' ' HIS . 17.7 m -65.77 -37.85 80.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.597 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.739 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -65.28 -41.58 94.03 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.74 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.82 -45.26 93.44 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.558 ' CE1' ' NZ ' ' A' ' 193' ' ' LYS . 23.1 m-85 -69.54 -47.31 64.12 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -65.62 -40.79 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.643 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 150' ' ' HIS . 56.6 t -64.05 -43.7 97.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.711 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.32 -44.54 96.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.448 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 18.4 mt -64.24 -43.78 93.85 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.848 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -70.33 -23.52 62.83 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.945 0.403 . . . . 0.0 110.025 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' THR . . . . . 0.583 ' O ' ' OG1' ' A' ' 162' ' ' THR . 52.0 m -73.24 -49.94 25.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.983 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.421 HD12 ' N ' ' A' ' 160' ' ' SER . 3.4 pp -76.57 -30.22 56.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.632 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.421 ' N ' HD12 ' A' ' 159' ' ' LEU . 67.5 m -60.66 -48.04 83.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.032 -179.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.499 ' HG3' ' N ' ' A' ' 162' ' ' THR . 19.5 ptp180 -75.42 -45.17 40.47 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.767 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.583 ' OG1' ' O ' ' A' ' 158' ' ' THR . 16.0 p -74.98 170.1 16.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.371 -178.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 65.15 -4.95 0.46 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.11 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.525 ' H ' ' C ' ' A' ' 162' ' ' THR . 97.1 mt-10 -146.25 23.21 1.33 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.342 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.447 ' O ' HG23 ' A' ' 165' ' ' ILE . 15.3 tt -57.47 132.42 21.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.428 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.438 ' O ' ' N ' ' A' ' 168' ' ' ASN . 5.9 t-80 -169.47 23.38 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.547 0.689 . . . . 0.0 109.489 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 167' ' ' GLU . 73.7 tt0 42.89 23.18 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.124 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 166' ' ' HIS . 20.8 t30 174.19 103.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.549 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 56.9 t -127.94 130.58 69.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.471 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.759 HG23 ' O ' ' A' ' 170' ' ' ILE . 20.3 tt -175.37 84.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.9 179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.02 154.91 18.81 Favored Pre-proline 0 N--CA 1.454 -0.253 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.254 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.43 66.68 2.84 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.562 2.175 . . . . 0.0 111.973 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 23.3 t -150.51 149.4 29.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.686 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -111.03 -43.32 3.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.537 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.534 ' O ' HG13 ' A' ' 178' ' ' ILE . 58.8 tp -145.2 98.54 3.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.206 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 31.2 t 62.12 -83.58 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.228 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -164.67 71.12 0.18 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.954 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.731 HD12 ' O ' ' A' ' 178' ' ' ILE . 2.2 pp -131.89 160.74 42.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.651 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.33 -7.48 50.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.252 179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 127.6 89.19 0.65 Allowed Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.57 ' O ' ' NE2' ' A' ' 184' ' ' HIS . 60.4 p -117.85 -40.52 2.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.682 0.277 . . . . 0.0 110.679 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.573 ' C ' ' H ' ' A' ' 184' ' ' HIS . 6.3 t -134.21 160.4 41.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.581 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.429 ' N ' HG12 ' A' ' 182' ' ' VAL . 6.0 tp 65.04 -11.44 0.15 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.689 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.602 ' ND1' ' N ' ' A' ' 184' ' ' HIS . 0.0 OUTLIER -63.93 -46.47 84.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.7 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.476 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 79.0 p -68.01 -40.52 82.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.777 -179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -64.0 -46.66 83.57 Favored 'General case' 0 C--O 1.242 0.707 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.746 -178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 187' ' ' HIS . . . . . 0.639 ' C ' ' ND1' ' A' ' 187' ' ' HIS . 0.1 OUTLIER -71.44 -34.35 70.18 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.977 179.505 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 188' ' ' THR . . . . . 0.625 ' N ' ' ND1' ' A' ' 187' ' ' HIS . 59.6 m -62.26 -44.79 95.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.892 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -61.4 -38.35 86.77 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.552 HD23 ' HE3' ' A' ' 193' ' ' LYS . 10.5 mt -60.96 -41.47 96.39 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.546 -0.462 . . . . 0.0 109.998 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.52 ' HA ' HD23 ' A' ' 194' ' ' LEU . 68.5 mttm -68.19 -35.02 77.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.16 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 86.0 tt0 -67.8 -44.93 76.18 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.153 0.501 . . . . 0.0 111.622 -178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.558 ' NZ ' ' CE1' ' A' ' 152' ' ' TYR . 0.0 OUTLIER -71.87 -38.75 69.99 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.064 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.779 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -65.15 -41.9 94.3 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.969 -0.693 . . . . 0.0 110.351 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 192' ' ' GLU . 18.8 ptp180 -65.27 -38.14 89.36 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 196' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 79.1 p -60.87 -39.03 87.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 194' ' ' LEU . 97.1 mt -63.72 -42.78 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -58.49 -41.52 85.52 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -60.37 -38.6 84.4 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 200' ' ' GLY . . . . . 0.416 ' O ' ' HB3' ' A' ' 203' ' ' ARG . . . -60.1 -40.3 96.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' A' ' 201' ' ' LEU . 19.8 mt -62.16 -40.59 96.51 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.012 -0.675 . . . . 0.0 109.742 178.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -60.31 -37.42 80.51 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 200' ' ' GLY . 5.2 tmm_? -60.84 -41.38 95.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.461 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.18 -38.17 82.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -61.08 -42.54 98.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.284 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 210' ' ' GLN . 5.7 mmp_? -64.48 -36.14 83.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.327 179.158 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.698 ' O ' ' N ' ' A' ' 211' ' ' GLY . 25.2 t -63.02 -44.95 99.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.194 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.59 -26.79 62.75 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.559 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 209' ' ' HIS . . . . . 0.426 ' ND1' ' NH1' ' A' ' 206' ' ' ARG . 45.1 t-80 -94.23 -12.93 27.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.372 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.3 tt0 -136.86 -38.33 0.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.093 0.473 . . . . 0.0 110.442 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.698 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -83.4 35.72 2.8 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -45.7 90.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.597 -0.301 . . . . 0.0 110.589 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 32.8 p -158.6 165.24 34.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.361 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.732 HG23 ' H ' ' A' ' 215' ' ' GLU . 0.0 OUTLIER -169.94 -71.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.877 -179.682 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.732 ' H ' HG23 ' A' ' 214' ' ' THR . 79.3 mm-40 47.38 69.73 0.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.852 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -136.18 140.74 43.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.834 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.607 ' O ' ' N ' ' A' ' 219' ' ' GLU . 77.8 mm-40 -117.79 -12.8 10.18 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 121.034 -0.267 . . . . 0.0 111.671 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.534 ' CG ' ' C ' ' A' ' 217' ' ' GLU . 0.2 OUTLIER 66.03 -57.3 0.35 Allowed 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -177.827 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.607 ' N ' ' O ' ' A' ' 217' ' ' GLU . 37.8 tt0 -125.29 -146.52 0.35 Allowed 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.145 -1.389 . . . . 0.0 108.007 179.183 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.534 ' H ' ' HG2' ' A' ' 219' ' ' GLU . 16.9 tp10 63.43 125.41 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -48.02 121.21 5.66 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 121.38 1.387 . . . . 0.0 112.811 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 178.69 -102.52 0.0 OUTLIER 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.146 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.489 HG21 HD22 ' A' ' 308' ' ' LEU . 2.6 p -60.62 -48.93 86.51 Favored 'Isoleucine or valine' 0 C--O 1.249 1.035 0 CA-C-O 121.704 0.764 . . . . 0.0 110.763 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.43 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.8 OUTLIER -63.81 -31.47 53.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.438 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 225' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 51.9 t0 -64.36 -37.99 89.46 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.4 tp -59.44 -42.84 92.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.625 ' CH2' HD23 ' A' ' 308' ' ' LEU . 45.9 m0 -60.36 -36.45 78.06 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.045 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 228' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 225' ' ' ASP . 94.0 m-20 -59.43 -40.93 88.33 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.475 ' C ' ' H ' ' A' ' 231' ' ' GLN . 8.8 mp -63.91 -40.67 97.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.321 0.582 . . . . 0.0 109.512 179.123 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.626 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -53.04 -8.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.846 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.853 ' O ' HD21 ' A' ' 240' ' ' LEU . 11.4 tp-100 -62.86 -43.73 98.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.795 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 54.0 p -145.0 16.48 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.576 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -59.67 -49.86 76.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.697 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.8 p30 177.54 77.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.595 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.626 HD12 ' O ' ' A' ' 230' ' ' ALA . 96.1 mt -137.19 161.89 34.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.674 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.0 p -72.95 -162.44 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.617 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -92.19 -55.58 3.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -61.93 -41.34 97.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.985 0.421 . . . . 0.0 110.335 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -63.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.853 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.2 OUTLIER -62.81 -43.02 99.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.162 -179.699 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -64.27 -49.44 71.87 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.856 0.36 . . . . 0.0 110.775 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.44 -39.77 94.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.978 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.5 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -68.01 -42.6 80.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.345 179.089 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 244' ' ' ARG . . . . . 0.542 ' NH2' ' OE1' ' A' ' 231' ' ' GLN . 59.2 ttm-85 -59.17 -50.17 75.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.976 -178.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.3 -40.61 86.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.791 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -62.07 -46.93 86.95 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.162 0.506 . . . . 0.0 110.415 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 251' ' ' GLU . 1.0 OUTLIER -62.02 -41.68 98.35 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.171 179.49 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.04 -42.88 81.3 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.119 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.42 -55.79 30.22 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.664 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -63.66 -33.85 76.54 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.694 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 29.3 tp10 -59.72 -43.33 94.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.053 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.44 86.65 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.398 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -59.9 -48.17 82.8 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.705 -179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 251' ' ' GLU . 1.3 tt -66.47 -31.76 55.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.272 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.32 -48.87 79.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.186 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.14 -42.25 99.44 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.372 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -57.64 -42.77 84.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.127 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.56 -40.43 96.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.356 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 259' ' ' HIS . . . . . 0.403 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 8.0 t60 -58.38 -48.06 81.83 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.239 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -62.81 -37.08 85.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.482 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -59.17 -45.5 90.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.789 0.328 . . . . 0.0 110.435 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -61.73 -45.43 93.99 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 263' ' ' GLN . . . . . 0.403 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.8 mp0 -64.94 -34.92 79.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.988 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.16 -43.12 99.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.335 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -65.31 -48.22 73.84 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.992 0.425 . . . . 0.0 110.66 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 66.5 mt -63.14 -43.33 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.128 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.07 -36.94 83.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.23 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -63.03 -46.59 86.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.378 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.98 -44.55 95.74 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.453 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.41 -42.87 99.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.465 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.712 HD23 ' O ' ' A' ' 271' ' ' LEU . 2.7 tt -60.72 -43.9 97.28 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.752 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -58.66 -44.75 90.25 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.165 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 -67.75 -36.01 79.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.626 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.408 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.96 -37.11 85.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.009 -179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -58.84 -17.06 20.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.396 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 60.4 p -89.3 2.62 54.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.68 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.544 HG13 ' N ' ' A' ' 278' ' ' GLY . 14.8 p -60.18 -43.48 93.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.677 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.544 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 119.67 -67.86 0.39 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -88.61 116.91 27.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.781 0.324 . . . . 0.0 110.349 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -64.95 116.05 8.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -145.34 -44.62 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.7 0.286 . . . . 0.0 110.408 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -105.76 -6.18 19.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.457 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.55 -45.8 96.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.528 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 284' ' ' SER . . . . . 0.418 ' O ' ' HG2' ' A' ' 288' ' ' GLU . 44.5 t -63.49 -51.63 64.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.513 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.82 -44.44 96.83 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.981 0.419 . . . . 0.0 110.853 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 38.6 m -60.32 -42.99 96.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.382 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -63.54 -38.33 90.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.933 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 288' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 284' ' ' SER . 76.0 mm-40 -59.89 -61.45 2.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.531 ' HD3' HD23 ' A' ' 292' ' ' LEU . 29.4 mmtt -63.4 -39.71 95.24 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.018 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -45.16 -55.41 5.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.938 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -65.43 -35.69 81.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.679 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.531 HD23 ' HD3' ' A' ' 289' ' ' LYS . 16.5 tp -60.63 -49.04 79.14 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.497 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.67 -41.52 98.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 109.973 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 295' ' ' GLY . 0.1 OUTLIER -63.92 -39.94 95.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 295' ' ' GLY . . . . . 0.401 ' N ' ' HG2' ' A' ' 294' ' ' GLU . . . -59.99 -50.78 63.99 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 -179.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 296' ' ' ARG . . . . . 0.433 ' CZ ' ' OE1' ' A' ' 299' ' ' GLU . 10.6 tpp180 -60.4 -37.79 81.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.909 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.1 m -58.91 -48.15 82.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.327 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -63.59 -41.53 98.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.729 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 299' ' ' GLU . . . . . 0.433 ' OE1' ' CZ ' ' A' ' 296' ' ' ARG . 96.6 mt-10 -58.77 -43.82 90.49 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.138 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.5 -43.99 97.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.393 -0.523 . . . . 0.0 109.906 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.75 -41.9 84.07 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -61.16 -45.88 92.83 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.145 0.498 . . . . 0.0 110.455 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.5 m -60.14 -43.37 95.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.313 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.36 -43.12 93.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.052 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -58.66 -46.12 87.85 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.805 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.99 -42.86 99.96 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.559 179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -65.42 -35.42 80.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.137 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.625 HD23 ' CH2' ' A' ' 227' ' ' TRP . 21.7 mt -62.29 -43.58 98.5 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.362 179.528 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 19.5 tm0? -65.49 -46.52 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -64.31 -49.02 73.43 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.079 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 33.1 mt -62.86 -42.78 99.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 51.0 m -60.95 -41.87 97.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.299 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.48 98.22 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.3 -47.99 79.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.773 0.32 . . . . 0.0 110.74 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.481 ' O ' ' C ' ' A' ' 316' ' ' SER . 17.0 mt -77.71 -25.4 14.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 316' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 315' ' ' ILE . 42.6 t -33.1 -54.59 0.39 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.742 -179.234 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.504 HH12 ' CD2' ' A' ' 323' ' ' LEU . 18.2 ptt85 -106.31 -32.6 8.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.484 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 44.0 58.47 3.64 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.063 0.458 . . . . 0.0 109.824 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 54.0 ptt85 -56.77 177.57 0.07 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.323 -179.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -70.62 134.2 47.37 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.097 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 75.27 150.63 0.11 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.042 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -46.48 137.57 6.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.629 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.504 ' CD2' HH12 ' A' ' 317' ' ' ARG . 9.8 mp . . . . . 0 C--O 1.219 -0.523 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.467 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 p -78.4 -4.88 50.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.603 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -62.98 -38.86 92.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.485 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -68.28 143.68 55.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.533 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -126.37 134.9 50.94 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.487 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 57.03 36.06 27.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.431 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.603 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -64.63 -41.14 55.36 Favored Pre-proline 0 C--O 1.231 0.123 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.244 -179.527 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 7' ' ' GLN . 35.1 Cg_exo -59.52 142.6 99.17 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.41 2.073 . . . . 0.0 112.078 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -155.43 149.97 20.06 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.316 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.38 155.45 63.88 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.671 2.247 . . . . 0.0 111.966 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -156.16 64.24 3.66 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.807 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.45 -14.81 22.48 Favored 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 122.751 2.301 . . . . 0.0 112.117 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt 72.56 36.64 0.97 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.627 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -61.93 -41.71 98.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.594 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 62.47 129.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.375 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.2 t -150.08 154.21 37.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.441 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -87.09 129.4 9.46 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -175.51 76.07 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.64 0.257 . . . . 0.0 110.426 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.436 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 55.6 mp0 -70.86 -41.26 71.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.027 0.441 . . . . 0.0 110.841 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -119.87 164.15 16.46 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.778 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -81.1 -15.43 55.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.936 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.04 145.85 51.15 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 121.401 0.62 . . . . 0.0 111.166 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -64.99 -36.51 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.363 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.1 tttp -57.57 -47.93 80.76 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.276 0.56 . . . . 0.0 110.466 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.3 mt -60.8 -39.47 89.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.344 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -63.47 -39.84 95.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -57.41 -48.91 77.86 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.373 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 28' ' ' LEU . 4.2 mm? -61.38 -42.82 99.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.23 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.501 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 46.5 t-105 -61.48 -42.35 98.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.266 0.555 . . . . 0.0 110.417 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -57.72 -44.6 86.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.403 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.8 -41.57 95.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.356 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.27 93.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.428 . . . . 0.0 110.427 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.501 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.5 mt-30 -62.46 -39.42 93.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.329 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.24 -40.92 97.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.361 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.02 -39.86 95.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.429 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.64 106.94 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.896 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -129.45 155.06 80.73 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -40.47 154.33 0.06 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.65 2.233 . . . . 0.0 112.245 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.93 -36.07 32.35 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.594 2.196 . . . . 0.0 112.296 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.73 -49.77 75.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.017 0.437 . . . . 0.0 110.747 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -68.25 -39.29 82.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.464 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -63.03 -43.41 98.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.88 -43.67 87.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.634 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.57 -44.26 74.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.765 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.63 -48.4 79.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.565 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -60.88 -41.63 96.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.35 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.622 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.69 -48.79 79.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.734 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -56.37 -47.92 77.9 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.536 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.64 -39.25 83.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.075 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.98 -38.07 84.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.95 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 47' ' ' ALA . 38.6 mm -62.92 -44.38 99.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.899 179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -58.31 -43.64 88.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.332 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -60.52 -47.48 85.98 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.171 0.51 . . . . 0.0 110.322 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -62.59 -41.33 98.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.693 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -63.87 -37.33 86.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.301 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -62.63 -46.99 85.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.103 0.477 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.1 tp -61.4 -41.32 96.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.995 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.04 -41.99 99.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.532 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -58.96 -43.35 91.3 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.924 0.393 . . . . 0.0 110.275 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.78 -45.87 92.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -57.75 -42.42 83.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.997 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.4 mt -62.53 -42.34 99.46 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.016 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -56.48 -43.65 79.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.63 -39.68 94.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.879 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -63.22 -21.56 66.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.988 179.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.75 35.63 3.98 Favored Glycine 0 C--N 1.335 0.473 0 N-CA-C 111.233 -0.747 . . . . 0.0 111.233 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 90.9 mt -123.25 -164.99 1.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.339 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 54.63 95.11 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.521 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -121.67 -39.93 2.59 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.619 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -62.2 -41.17 98.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.643 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 88.41 6.93 73.32 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -60.48 -39.18 86.71 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.345 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.518 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 3.4 mptp? -54.79 -55.87 25.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.914 0.388 . . . . 0.0 110.52 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -57.84 -39.89 78.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.021 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.53 -41.38 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.54 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.518 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 89.7 mtm180 -65.16 -39.98 93.7 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.69 -44.91 92.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.392 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.53 -45.14 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.238 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.493 ' O ' HG23 ' A' ' 83' ' ' VAL . 73.4 ttt180 -60.63 -43.24 97.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.128 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.455 ' OD1' HD11 ' A' ' 84' ' ' ILE . 26.0 t-20 -64.06 -40.13 95.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.58 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.688 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.45 -46.68 88.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.045 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -64.92 -39.87 94.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.588 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.8 t -63.75 -46.5 94.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.432 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.455 HD11 ' OD1' ' A' ' 80' ' ' ASN . 96.6 mt -60.13 -49.88 82.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.558 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' A' ' 85' ' ' LEU . 19.3 mt -65.09 -40.69 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.062 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.01 -41.1 97.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.795 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -64.77 -46.78 80.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.775 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -76.05 -19.59 58.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.394 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 65.29 26.53 71.7 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.9 mt -97.65 13.42 30.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 110.669 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 92' ' ' GLY . 38.4 p-10 -62.77 -37.64 87.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.69 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.51 ' N ' ' OD1' ' A' ' 91' ' ' ASP . . . 119.47 159.39 10.95 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -138.03 124.39 20.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.912 0.387 . . . . 0.0 110.397 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -144.12 150.53 38.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.89 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.459 ' OD1' ' N ' ' A' ' 96' ' ' ALA . 65.3 t0 -72.32 131.33 42.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.608 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.459 ' N ' ' OD1' ' A' ' 95' ' ' ASP . . . -108.72 125.25 51.7 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.228 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -121.32 -9.72 9.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.854 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -75.64 127.98 34.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.606 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 71.0 t -62.85 -46.87 95.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.738 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.1 t -155.95 153.24 29.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.66 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 66.8 m -105.9 114.62 28.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.284 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -105.1 1.11 28.12 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.653 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 83.9 p -65.9 135.24 54.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.374 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.42 ' N ' HD12 ' A' ' 104' ' ' LEU . 10.9 mp 44.52 66.59 0.83 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.211 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.7 t -63.28 -43.19 98.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.73 -179.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 68.83 95.2 0.05 OUTLIER Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 13.1 p -100.72 0.35 38.78 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.736 0.303 . . . . 0.0 110.775 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 57.45 160.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.563 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -148.89 159.28 44.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.636 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.479 ' CG ' ' H ' ' A' ' 111' ' ' GLY . 26.4 t0 -145.57 -172.65 3.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.633 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.479 ' H ' ' CG ' ' A' ' 110' ' ' ASP . . . -62.06 -51.79 54.48 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.517 ' H ' HD12 ' A' ' 112' ' ' LEU . 0.0 OUTLIER -127.12 48.0 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.879 0.371 . . . . 0.0 110.498 -179.732 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.412 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 31.5 p-10 -65.16 -27.75 68.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.444 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -99.39 147.77 33.77 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.452 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.452 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 35.1 Cg_endo -64.79 -24.1 61.95 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.619 2.213 . . . . 0.0 111.87 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.636 ' CZ ' HH21 ' A' ' 205' ' ' ARG . 76.9 ttt-85 -62.98 -46.07 89.45 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.947 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.56 -39.55 77.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.954 0.407 . . . . 0.0 110.663 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -60.51 -39.24 87.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.521 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.572 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.4 mttt -61.0 -44.2 97.77 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.494 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.75 -46.54 84.85 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.943 0.402 . . . . 0.0 111.71 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.587 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.7 t-105 -60.0 -47.54 85.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.369 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -71.17 -32.97 69.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.429 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.572 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.8 OUTLIER -56.59 -51.02 70.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.86 -178.978 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.63 -46.74 58.22 Favored 'General case' 0 C--O 1.247 0.936 0 C-N-CA 120.017 -0.673 . . . . 0.0 110.596 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -52.97 -45.21 67.69 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.914 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.7 m -85.41 -40.94 15.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.691 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.557 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 13.7 m -44.54 -29.88 0.79 Allowed 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -155.36 -96.59 0.13 Allowed Glycine 0 N--CA 1.463 0.472 0 C-N-CA 119.751 -1.214 . . . . 0.0 111.31 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.731 ' O ' ' N ' ' A' ' 131' ' ' SER . 65.1 mttp -154.51 17.58 0.47 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -57.93 51.04 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.811 -179.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.731 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.5 m -109.13 123.54 49.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.139 0.495 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.61 -97.8 1.2 Allowed Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.142 178.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -74.96 -39.87 61.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.993 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.401 ' O ' HD23 ' A' ' 138' ' ' LEU . 58.5 mp0 -63.45 -52.71 60.28 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.067 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.587 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -59.8 -39.96 86.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.352 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -61.82 -38.66 88.99 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -63.1 -42.89 99.66 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.444 0.64 . . . . 0.0 109.854 178.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 138' ' ' LEU . 4.2 mm? -59.45 -42.55 92.23 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.21 -37.57 87.94 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -53.54 -41.16 66.15 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 178.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.931 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 79.9 mm-40 -69.66 -47.32 63.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -57.42 -48.75 78.29 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.2 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 143' ' ' LEU . 95.2 mt -59.76 -41.33 90.78 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.071 -0.651 . . . . 0.0 110.205 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.931 ' ND1' ' O ' ' A' ' 141' ' ' GLU . 1.8 p-80 -55.84 -43.03 76.65 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.024 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.706 ' N ' ' CD2' ' A' ' 144' ' ' HIS . 2.7 m80 -59.8 -41.98 92.42 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.449 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -62.65 -42.44 99.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.313 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.555 ' HA ' ' CE1' ' A' ' 150' ' ' HIS . 96.5 mt-10 -67.59 -44.09 78.95 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.206 0.527 . . . . 0.0 111.297 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.47 -42.24 71.71 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.146 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.99 -50.56 76.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.828 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.1 OUTLIER -72.75 -18.89 61.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.25 -179.642 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.638 ' HG2' ' CE1' ' A' ' 150' ' ' HIS . 9.7 mm-40 -70.89 -48.69 52.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.528 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 29.2 m-85 -63.77 -41.22 98.02 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.767 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.85 -38.46 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.938 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.828 HG23 ' O ' ' A' ' 150' ' ' HIS . 19.3 t -61.25 -46.28 96.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.265 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.1 mt -65.28 -44.88 86.58 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.814 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -64.31 -43.81 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.064 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' A' ' 154' ' ' VAL . 0.6 OUTLIER -68.68 -29.67 68.17 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.103 0.477 . . . . 0.0 109.982 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 158' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 154' ' ' VAL . 66.1 m -65.36 -48.69 72.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.811 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.769 HD22 HH22 ' A' ' 186' ' ' ARG . 2.3 pp -79.11 -21.12 47.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.762 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.434 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 95.7 p -65.38 -35.88 82.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.826 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -61.97 -46.36 89.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.293 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.699 ' C ' ' H ' ' A' ' 164' ' ' GLU . 2.9 t -100.49 174.22 6.2 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.442 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 62.41 -16.36 0.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.962 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.699 ' H ' ' C ' ' A' ' 162' ' ' THR . 59.3 tt0 -111.38 43.64 1.46 Allowed 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.662 179.708 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.7 tt -134.57 140.45 45.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.066 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.435 ' O ' ' CG ' ' A' ' 167' ' ' GLU . 19.6 t-80 -176.19 24.21 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.435 ' CG ' ' O ' ' A' ' 166' ' ' HIS . 14.3 pt-20 43.3 31.13 0.36 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.891 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -165.78 -66.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.338 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 4.4 t 47.46 71.67 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.739 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.504 HG23 ' O ' ' A' ' 170' ' ' ILE . 20.5 tt -177.49 126.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.626 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -162.89 165.44 14.94 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.272 179.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.39 139.76 64.3 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.511 2.141 . . . . 0.0 111.952 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 1.6 p -145.96 138.1 25.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.418 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -129.03 -32.64 2.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.517 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 178' ' ' ILE . 51.9 tp -63.06 101.32 0.27 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.509 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.628 ' O ' ' CG ' ' A' ' 177' ' ' ASP . 0.9 OUTLIER 43.57 35.0 0.89 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.257 179.505 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.628 ' CG ' ' O ' ' A' ' 176' ' ' SER . 4.8 p-10 49.63 24.6 1.22 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.553 ' C ' HD12 ' A' ' 178' ' ' ILE . 2.6 pp -132.95 165.93 30.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.105 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -113.25 131.24 55.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.42 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 140.36 142.65 4.21 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 39.9 t -93.05 -43.46 8.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 110.896 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.652 ' O ' HG12 ' A' ' 182' ' ' VAL . 60.3 t -129.13 8.15 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.983 0.421 . . . . 0.0 110.825 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 183' ' ' LEU . 12.0 tp -52.08 -7.11 0.05 Allowed 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.262 0.553 . . . . 0.0 110.875 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.54 ' ND1' ' N ' ' A' ' 184' ' ' HIS . 0.2 OUTLIER -56.35 -39.09 72.31 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.155 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 58.7 p -60.83 -42.34 97.54 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.053 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.769 HH22 HD22 ' A' ' 159' ' ' LEU . 3.0 tpt180 -62.08 -45.3 94.11 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 120.926 0.393 . . . . 0.0 110.642 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -65.69 -38.44 89.26 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.326 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 61.6 m -60.68 -44.85 96.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.073 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.455 ' O ' ' CD ' ' A' ' 193' ' ' LYS . 97.5 mt-10 -61.2 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.077 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.468 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 3.5 mt -61.23 -42.05 97.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.351 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.84 -29.36 67.67 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 76.3 tt0 -69.94 -50.97 36.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.978 0.418 . . . . 0.0 111.629 -179.122 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.528 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 1.1 ptmt -71.94 -39.41 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.783 -0.367 . . . . 0.0 111.247 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.795 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.45 -41.45 72.82 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.93 -179.493 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.518 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 50.2 ptt85 -65.87 -37.46 86.2 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 96.0 p -62.73 -41.45 99.19 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.577 HG23 ' CD2' ' A' ' 145' ' ' HIS . 91.9 mt -65.72 -43.69 93.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.824 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -63.51 -41.27 98.51 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.685 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.855 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 47.1 mm-40 -63.5 -33.02 74.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.207 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.57 -40.6 90.73 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 201' ' ' LEU . 37.3 mt -63.74 -43.34 96.76 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.205 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.904 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 9.1 p-10 -65.82 -34.23 77.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.595 0.712 . . . . 0.0 109.213 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.904 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.1 tmt_? -63.43 -42.6 98.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.375 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 204' ' ' LEU . 49.4 mt -61.18 -39.78 91.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.636 HH21 ' CZ ' ' A' ' 116' ' ' ARG . 33.6 mmt180 -60.19 -43.1 96.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.045 179.337 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.611 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.8 mtm-85 -64.76 -36.79 85.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.391 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.67 ' O ' ' N ' ' A' ' 211' ' ' GLY . 47.2 t -63.17 -46.46 95.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.041 0.448 . . . . 0.0 110.176 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.7 p -74.24 -26.64 60.35 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.928 0.394 . . . . 0.0 110.764 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -95.05 -14.37 24.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.292 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.611 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -138.11 -30.19 0.81 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.043 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.67 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -73.18 15.49 2.49 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.463 ' H ' ' C ' ' A' ' 210' ' ' GLN . 2.5 t80 -64.09 -63.16 1.22 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.967 0.413 . . . . 0.0 110.604 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.451 ' O ' ' OG ' ' A' ' 213' ' ' SER . 0.5 OUTLIER 174.75 81.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.273 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 7.0 p -104.22 -11.88 16.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.63 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 55.68 177.88 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.501 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -106.82 170.21 8.08 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.918 0.39 . . . . 0.0 111.15 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -143.08 30.98 1.4 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.987 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.49 ' O ' ' C ' ' A' ' 219' ' ' GLU . 70.2 m-85 -84.03 157.51 21.79 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.498 0.666 . . . . 0.0 109.687 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.49 ' C ' ' O ' ' A' ' 218' ' ' PHE . 81.9 tt0 -34.59 -48.16 0.35 Allowed 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.114 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.86 ' O ' HG12 ' A' ' 223' ' ' VAL . 39.5 tp10 -174.01 126.77 0.44 Allowed Pre-proline 0 C--O 1.225 -0.19 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.811 176.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.631 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 72.6 Cg_exo -43.42 159.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.377 2.051 . . . . 0.0 111.755 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.631 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 65.8 ttp85 95.74 -54.44 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.619 0.575 . . . . 0.0 110.705 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 1.007 HG13 ' H ' ' A' ' 224' ' ' ILE . 4.9 p -55.91 -83.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.598 0 CA-C-O 121.351 0.596 . . . . 0.0 110.878 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 1.007 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -57.1 -24.58 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.036 -179.797 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -64.36 -47.55 78.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.096 0.474 . . . . 0.0 109.731 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.433 HD23 HD12 ' A' ' 229' ' ' LEU . 24.1 mt -61.35 -42.82 99.31 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.77 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.493 ' HB3' HD11 ' A' ' 247' ' ' LEU . 43.6 m0 -60.88 -36.17 78.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.983 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 228' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 228' ' ' ASP . 64.8 t0 -63.74 -38.3 90.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.663 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 231' ' ' GLN . 95.0 mt -62.62 -42.18 99.43 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.1 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.403 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -38.12 -25.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.095 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 229' ' ' LEU . 55.7 tt0 -69.65 -72.47 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.805 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 79.1 p -66.18 -18.49 65.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -57.4 -53.88 53.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.876 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 234' ' ' ASN . . . . . 0.64 ' CG ' ' H ' ' A' ' 235' ' ' LEU . 0.5 OUTLIER -178.79 -143.11 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.046 -179.308 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.64 ' H ' ' CG ' ' A' ' 234' ' ' ASN . 36.7 mt 80.32 144.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.661 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 24.1 p -80.57 172.47 13.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 237' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 33.0 p-10 -55.86 -44.12 77.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.638 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 238' ' ' LYS . . . . . 0.467 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.6 -47.99 81.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.011 0.434 . . . . 0.0 110.662 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -65.85 -36.11 82.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.68 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.755 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.46 -43.12 98.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.196 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -62.9 -48.97 76.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.477 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.17 -48.69 80.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.504 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -63.64 -39.72 95.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.323 179.283 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -57.44 -50.32 73.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.961 0.41 . . . . 0.0 110.528 -179.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.61 -36.26 83.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.563 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -60.13 -51.87 67.77 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.51 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.51 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.12 -40.38 97.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.886 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 79.3 tttt -55.65 -45.4 77.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.196 0.522 . . . . 0.0 110.337 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.86 -37.03 81.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.288 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -61.23 -49.33 77.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.065 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 11.9 pt-20 -62.83 -37.08 85.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.058 0.456 . . . . 0.0 109.851 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.83 87.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.617 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -63.53 -48.97 75.36 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.245 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.5 tt -64.2 -34.17 67.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.26 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -63.05 -48.34 79.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.053 0.454 . . . . 0.0 110.399 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.217 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 257' ' ' HIS . . . . . 0.479 ' CE1' HE21 ' A' ' 261' ' ' GLN . 7.2 t-80 -55.75 -43.2 76.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.029 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -61.83 -40.47 95.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.088 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -59.16 -47.83 83.85 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.249 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -64.24 -32.91 74.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.378 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 261' ' ' GLN . . . . . 0.479 HE21 ' CE1' ' A' ' 257' ' ' HIS . 20.1 mm-40 -61.08 -48.69 80.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.861 0.363 . . . . 0.0 110.186 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -61.93 -43.54 98.64 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 38.3 tp60 -64.27 -36.85 85.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.002 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 41.6 tp -62.4 -42.47 99.45 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.137 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -62.41 -46.05 90.34 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.381 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 88.0 mt -62.51 -43.48 98.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.3 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.2 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.39 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -61.28 -46.96 88.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.211 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -61.93 -46.15 90.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.37 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -62.0 -39.2 91.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.52 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.661 HD23 ' O ' ' A' ' 271' ' ' LEU . 1.3 tt -60.11 -44.16 95.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.887 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -63.08 -40.19 96.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.271 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -67.33 -41.61 84.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.759 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.747 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.6 -41.92 99.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.82 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -56.95 -17.56 10.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.94 0.4 . . . . 0.0 110.539 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.6 t -62.6 -34.09 76.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.542 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.838 HG13 ' H ' ' A' ' 279' ' ' ASP . 8.4 p -59.16 -40.03 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.323 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 64.94 26.93 71.6 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 279' ' ' ASP . . . . . 0.838 ' H ' HG13 ' A' ' 277' ' ' VAL . 25.6 t0 -108.19 -8.8 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.318 . . . . 0.0 110.556 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 280' ' ' GLY . . . . . 0.62 ' C ' ' H ' ' A' ' 282' ' ' ARG . . . 63.99 -141.64 45.28 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 281' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 281' ' ' GLU . 78.2 tt0 58.56 -5.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 282' ' ' ARG . . . . . 0.62 ' H ' ' C ' ' A' ' 280' ' ' GLY . 41.9 ttm180 -140.02 -31.07 0.66 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.516 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.83 -44.07 98.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.418 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 39.6 t -60.78 -53.15 60.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.08 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 74.0 mtp85 -60.82 -46.63 89.79 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.913 0.387 . . . . 0.0 111.064 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 19.6 m -59.1 -40.24 84.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -65.78 -39.38 90.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.547 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -58.7 -59.65 5.07 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.28 0.562 . . . . 0.0 110.429 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.607 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.5 mmtm -63.23 -35.84 81.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.309 179.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -52.16 -49.04 64.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.045 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.66 -31.93 70.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.258 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.607 HD23 ' HD3' ' A' ' 289' ' ' LYS . 16.8 tp -64.25 -53.29 51.46 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.51 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.0 mp -63.6 -41.53 98.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.012 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -64.77 -39.57 93.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.169 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.15 -45.43 96.57 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 296' ' ' ARG . . . . . 0.653 ' HE ' ' C ' ' A' ' 296' ' ' ARG . 1.4 tmm_? -63.63 -41.88 98.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.058 0.456 . . . . 0.0 110.14 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.1 m -58.45 -49.59 76.78 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.47 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -40.13 96.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.417 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -58.48 -42.67 88.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -44.31 96.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.919 0.39 . . . . 0.0 110.462 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.28 -45.42 92.77 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -62.11 -41.76 98.55 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.098 0.475 . . . . 0.0 110.463 179.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 14.5 m -61.1 -43.97 98.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.502 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -60.03 -43.21 92.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.96 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -59.16 -48.97 79.63 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.196 0.522 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -61.74 -44.8 96.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.226 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.581 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.8 OUTLIER -63.36 -36.05 82.42 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.471 ' O ' ' OG ' ' A' ' 312' ' ' SER . 0.4 OUTLIER -58.0 -45.42 86.85 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.413 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -71.66 -57.63 4.21 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.272 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.34 -49.58 76.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.55 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 4.4 tp -61.55 -43.03 99.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.506 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 312' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 51.8 p -60.0 -40.54 89.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.15 -38.27 95.06 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.24 -45.0 95.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.78 0.324 . . . . 0.0 110.659 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.657 ' O ' ' N ' ' A' ' 318' ' ' ALA . 4.1 mm -61.0 -100.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.454 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 316' ' ' SER . . . . . 0.53 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.4 m 30.54 -87.11 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.309 0.576 . . . . 0.0 110.264 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.741 ' HG3' ' H ' ' A' ' 319' ' ' ARG . 11.4 ptp85 -59.19 -44.17 92.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.46 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.657 ' N ' ' O ' ' A' ' 315' ' ' ILE . . . 77.45 12.96 1.98 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.44 178.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.741 ' H ' ' HG3' ' A' ' 317' ' ' ARG . 94.9 mtt180 -147.72 115.28 6.34 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.137 0.494 . . . . 0.0 111.761 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -157.73 -50.69 0.07 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.319 179.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -135.57 -79.71 0.43 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.208 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -133.5 51.69 2.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.714 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.972 ' O ' HD13 ' A' ' 323' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.217 -0.644 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.419 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 86.8 t80 . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.2 p -67.62 -48.15 67.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.099 -179.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -138.44 151.54 47.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.433 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -114.44 103.04 10.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.248 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -61.6 -38.55 88.02 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.189 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -90.19 142.9 27.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.418 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.837 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -165.35 -45.01 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.823 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.837 ' HD2' ' H ' ' A' ' 7' ' ' GLN . 87.4 Cg_endo -79.99 149.81 20.34 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 122.37 2.047 . . . . 0.0 112.215 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -148.95 146.58 21.87 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.062 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -63.49 147.03 93.46 Favored 'Trans proline' 0 N--CA 1.501 1.941 0 C-N-CA 122.333 2.022 . . . . 0.0 112.048 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.4 p -151.85 140.9 13.92 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.09 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -69.51 148.57 66.99 Favored 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 122.554 2.169 . . . . 0.0 112.42 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -102.89 109.65 21.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.639 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.523 ' O ' ' O ' ' A' ' 15' ' ' GLU . 61.3 ttp180 -138.84 115.33 10.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.263 179.563 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.523 ' O ' ' O ' ' A' ' 14' ' ' ARG . 78.9 tt0 56.2 132.92 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.911 0.386 . . . . 0.0 110.573 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.5 t -57.55 -95.25 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.473 ' C ' ' OE1' ' A' ' 18' ' ' GLU . . . 80.05 -164.47 48.14 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.473 ' OE1' ' C ' ' A' ' 17' ' ' GLY . 58.6 mp0 48.58 100.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.742 0.305 . . . . 0.0 110.513 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -103.75 -15.01 15.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.788 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -132.7 152.07 51.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.774 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -67.25 -18.77 65.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.88 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.4 mmt -129.6 148.05 51.46 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.295 0.569 . . . . 0.0 111.116 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.669 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 49.7 mp0 -66.42 -40.94 89.86 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.698 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -56.01 -47.79 77.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.121 0.486 . . . . 0.0 110.469 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 25' ' ' LEU . 94.8 mt -61.59 -39.41 91.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.295 0.569 . . . . 0.0 109.506 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.24 -40.25 95.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.185 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.48 -42.71 96.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.209 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.88 -43.8 98.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.944 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.577 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 56.7 t-105 -61.8 -44.01 97.71 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.293 0.568 . . . . 0.0 110.369 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -56.66 -42.6 79.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.103 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.24 -42.93 99.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.205 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.73 -41.25 90.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.99 0.424 . . . . 0.0 110.274 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.577 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 73.8 mt-30 -58.79 -47.29 85.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.184 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -63.56 -34.77 78.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.19 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 35' ' ' LEU . 14.4 tp -62.43 -36.64 83.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.284 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 35' ' ' LEU . 21.3 m-70 65.89 110.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.074 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -134.74 154.19 79.3 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.74 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -40.61 153.92 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 122.562 2.174 . . . . 0.0 112.423 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.86 -50.2 5.59 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.682 2.255 . . . . 0.0 112.457 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.27 -47.82 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.575 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.4 ' NH2' ' CZ ' ' A' ' 88' ' ' TYR . 64.8 ttt-85 -63.24 -39.47 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.083 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.89 -44.42 96.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.716 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.63 94.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.401 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.58 -44.99 69.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.449 HD13 ' OH ' ' A' ' 88' ' ' TYR . 44.3 tp -63.46 -46.87 84.24 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -62.09 -42.27 99.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.37 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.29 90.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.457 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -59.71 -52.56 64.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.495 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.51 -39.73 94.45 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.2 0.524 . . . . 0.0 110.378 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.3 -45.53 87.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.016 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.61 -42.68 96.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.822 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -52.28 -42.93 64.13 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -64.86 -41.31 95.79 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -61.63 -46.71 88.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.241 0.543 . . . . 0.0 110.586 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -63.28 -35.7 81.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.485 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.41 ' OE1' ' C ' ' A' ' 56' ' ' GLU . 10.4 tm-20 -58.14 -47.66 82.65 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.985 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 57' ' ' LEU . 30.7 mt -62.31 -42.38 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.305 179.291 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.03 -44.36 96.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.477 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.5 t90 -59.14 -41.63 88.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -60.16 -45.89 91.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -58.39 -43.28 88.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.977 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -61.91 -39.41 91.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.851 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.35 -41.96 90.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.71 -43.93 97.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.056 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -73.56 -22.44 60.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.18 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 87.36 13.24 66.03 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.8 mt -64.33 -41.64 96.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.69 0.281 . . . . 0.0 111.003 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -86.56 116.44 24.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.563 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -129.8 -31.73 1.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.414 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -63.05 -41.81 99.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.77 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 89.02 2.76 77.41 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -68.15 -34.25 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.859 0.362 . . . . 0.0 110.622 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.5 mttt -59.03 -59.05 6.09 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.71 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 13.5 pt-20 -58.76 -39.23 80.39 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.043 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.403 ' N ' ' HG3' ' A' ' 74' ' ' GLU . . . -58.75 -41.43 86.48 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.406 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -64.95 -41.2 95.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.9 0.381 . . . . 0.0 110.07 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.27 -43.9 93.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.253 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 94.2 mt -64.24 -47.49 89.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.07 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.675 ' O ' HG23 ' A' ' 83' ' ' VAL . 10.3 tpp180 -60.42 -44.21 95.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.194 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.436 ' O ' HG13 ' A' ' 84' ' ' ILE . 44.9 t30 -61.91 -41.04 97.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.511 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.61 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.01 -50.13 74.48 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.129 -179.427 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -64.93 -37.17 86.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.32 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 79' ' ' ARG . 59.0 t -63.78 -45.96 95.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.442 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.01 -51.23 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.464 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.419 HD21 ' HA ' ' A' ' 91' ' ' ASP . 12.7 tp -66.63 -40.36 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.788 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.56 79.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.966 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -61.4 -47.94 83.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.55 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.449 ' OH ' HD13 ' A' ' 45' ' ' LEU . 5.7 m-85 -61.95 -30.29 70.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.069 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.02 18.94 80.16 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 51.2 mt -88.91 2.36 53.91 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.323 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.419 ' HA ' HD21 ' A' ' 85' ' ' LEU . 67.7 t0 -60.42 -41.03 93.13 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.409 -179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.69 163.5 32.71 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.45 ' HG2' ' H ' ' A' ' 95' ' ' ASP . 65.5 tttm -148.51 158.66 44.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.921 0.391 . . . . 0.0 110.476 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -79.62 7.88 7.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.53 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.45 ' H ' ' HG2' ' A' ' 93' ' ' LYS . 67.1 t0 -61.43 -41.43 97.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.748 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 63.8 112.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.863 0.363 . . . . 0.0 110.807 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -137.78 144.47 41.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.278 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -162.17 123.71 2.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.591 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.32 137.12 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.835 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 99.9 m -108.67 110.91 22.46 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.579 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.1 p -168.34 165.27 12.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.643 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 66.0 t30 54.34 85.85 0.05 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.713 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.0 t -112.85 124.72 53.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.451 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.0 mp -128.86 148.81 50.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.621 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.9 m -68.33 -77.94 0.07 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.678 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 55.19 91.58 0.01 OUTLIER Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.439 ' OG1' ' N ' ' A' ' 108' ' ' GLN . 29.7 p -88.51 -62.99 1.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.931 0.396 . . . . 0.0 110.706 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.439 ' N ' ' OG1' ' A' ' 107' ' ' THR . 58.3 tt0 -151.68 155.74 38.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.545 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.42 ' OE1' ' OD2' ' A' ' 113' ' ' ASP . 69.2 mm-40 -124.07 133.98 53.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.65 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.423 ' C ' ' OD1' ' A' ' 110' ' ' ASP . 53.8 p30 -160.76 -174.28 4.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.628 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -45.44 -64.85 2.13 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.486 HD23 ' N ' ' A' ' 112' ' ' LEU . 0.1 OUTLIER -122.6 87.9 2.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.857 0.36 . . . . 0.0 110.777 -179.776 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.42 ' OD2' ' OE1' ' A' ' 109' ' ' GLU . 33.0 p30 -94.64 -10.44 31.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.414 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -100.41 128.9 29.13 Favored Pre-proline 0 C--O 1.233 0.201 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.418 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -49.69 -35.47 38.49 Favored 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.41 2.073 . . . . 0.0 112.11 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -61.8 -45.13 95.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.871 0.367 . . . . 0.0 110.973 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.83 -38.52 89.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.542 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.458 ' HG2' HD12 ' A' ' 112' ' ' LEU . 97.7 mt-10 -61.67 -38.13 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.579 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.602 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 63.7 mttp -61.22 -45.74 93.31 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.54 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.529 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 41.5 mt -64.13 -46.15 85.43 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.913 0.387 . . . . 0.0 111.888 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.648 ' CE2' HD13 ' A' ' 135' ' ' LEU . 18.0 t-105 -57.8 -49.38 76.82 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.755 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -72.76 -31.99 65.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.46 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 1.0 OUTLIER -54.82 -51.52 65.59 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.73 -179.109 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.71 -46.59 52.9 Favored 'General case' 0 C--O 1.247 0.924 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.69 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 49.7 tttm -50.34 -41.59 51.6 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.781 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.5 m -95.08 -38.14 10.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.95 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -45.45 -27.34 0.7 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.961 0.41 . . . . 0.0 109.952 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.79 -92.26 0.09 OUTLIER Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.339 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -162.79 25.1 0.1 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.361 0.6 . . . . 0.0 109.525 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.423 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 8.7 m-85 -69.76 51.06 0.11 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.378 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 2.0 m -106.48 139.11 41.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.25 0.548 . . . . 0.0 111.747 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 89.12 -98.11 2.4 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.589 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 81.6 mm-40 -72.96 -43.83 61.83 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.96 -179.311 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -61.27 -49.35 77.42 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.304 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.648 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.5 mt -59.73 -40.4 87.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.306 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.56 -41.01 98.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.026 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.8 mttt -60.56 -42.75 97.24 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 121.387 0.613 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.71 -42.96 94.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.29 94.26 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.834 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -51.69 -41.64 61.6 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.65 -40.89 76.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.508 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.529 ' HZ ' HD13 ' A' ' 120' ' ' LEU . 10.7 m-85 -60.38 -52.43 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.429 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.36 -41.09 92.98 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.247 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -53.88 -46.69 71.41 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.51 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.833 ' O ' HG22 ' A' ' 149' ' ' VAL . 9.3 m-70 -61.37 -40.58 94.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -59.37 -43.67 92.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.343 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 143' ' ' LEU . 3.7 mp0 -70.7 -46.88 62.3 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.553 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.5 mttp -62.15 -47.05 86.26 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.12 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.833 HG22 ' O ' ' A' ' 145' ' ' HIS . 26.1 m -65.59 -37.13 79.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.02 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.724 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -63.81 -41.19 97.94 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.416 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -65.47 -45.65 82.87 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.332 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -62.86 -47.25 84.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 110.616 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ASN . . . . . 0.404 ' O ' ' CG ' ' A' ' 157' ' ' GLU . 12.8 m-20 -70.54 -46.61 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.226 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 150' ' ' HIS . 75.6 t -62.27 -46.06 97.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.702 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.74 -51.69 66.14 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.447 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.716 ' C ' HD12 ' A' ' 156' ' ' LEU . 0.4 OUTLIER -66.1 -38.19 87.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.217 0.532 . . . . 0.0 110.515 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 157' ' ' GLU . . . . . 0.539 ' N ' ' HG ' ' A' ' 156' ' ' LEU . 93.2 mt-10 -69.28 -33.75 73.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.34 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 64.0 m -65.97 -46.01 79.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.963 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.718 HD12 ' N ' ' A' ' 160' ' ' SER . 4.1 pp -77.55 -24.51 49.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.868 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.718 ' N ' HD12 ' A' ' 159' ' ' LEU . 81.9 p -67.6 -39.81 84.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.854 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -65.22 -44.71 87.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.188 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.681 HG22 ' H ' ' A' ' 163' ' ' GLU . 1.6 m -96.18 176.52 6.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.636 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.681 ' H ' HG22 ' A' ' 162' ' ' THR . 70.9 mm-40 54.66 2.76 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.014 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.596 ' H ' ' C ' ' A' ' 162' ' ' THR . 65.1 tt0 -135.46 43.14 2.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.691 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.491 ' O ' ' CG ' ' A' ' 166' ' ' HIS . 16.6 tt -134.42 129.3 52.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.969 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.491 ' CG ' ' O ' ' A' ' 165' ' ' ILE . 73.9 m80 -159.36 24.45 0.19 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.745 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 167' ' ' GLU . 76.6 tt0 44.1 45.6 6.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.427 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -153.88 159.22 41.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.404 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 5.8 m -152.9 37.45 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.676 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.434 HG23 ' O ' ' A' ' 170' ' ' ILE . 19.4 tt -154.54 130.81 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.64 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.49 158.27 1.99 Allowed Pre-proline 0 C--N 1.328 -0.342 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.388 179.403 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -55.64 141.23 84.1 Favored 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.55 2.167 . . . . 0.0 112.011 179.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.547 ' OG ' ' N ' ' A' ' 178' ' ' ILE . 22.9 t -154.91 130.78 10.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.695 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -101.66 -17.56 16.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.632 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.706 ' O ' ' N ' ' A' ' 177' ' ' ASP . 6.5 tt -112.49 113.91 26.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.966 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 176' ' ' SER . . . . . 0.405 ' HB2' HD23 ' A' ' 175' ' ' LEU . 10.6 m 46.22 -79.32 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.163 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.706 ' N ' ' O ' ' A' ' 175' ' ' LEU . 47.5 t0 -154.62 24.15 0.46 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.783 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.629 HD11 HD22 ' A' ' 175' ' ' LEU . 1.7 pp -139.47 166.42 21.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.856 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -65.05 134.64 54.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.222 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -62.58 130.92 43.73 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.515 ' OG ' ' N ' ' A' ' 182' ' ' VAL . 0.3 OUTLIER 175.47 -83.66 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.763 0.316 . . . . 0.0 110.58 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.616 ' C ' ' H ' ' A' ' 184' ' ' HIS . 97.0 t -140.59 -97.59 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.744 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.513 ' O ' ' HG2' ' A' ' 186' ' ' ARG . 9.7 tp 62.37 -37.69 0.14 Allowed 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.387 0.613 . . . . 0.0 110.848 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.616 ' H ' ' C ' ' A' ' 182' ' ' VAL . 13.8 p80 -56.93 -25.4 57.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.428 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.458 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 11.6 t -63.81 -46.02 87.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.514 -179.654 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.736 ' O ' HD13 ' A' ' 190' ' ' LEU . 21.0 ptt180 -71.07 -41.57 70.53 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.326 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 187' ' ' HIS . . . . . 0.624 ' CE1' ' HE ' ' A' ' 186' ' ' ARG . 52.4 m-70 -65.02 -39.54 93.53 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.22 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 56.7 m -63.56 -44.16 94.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.996 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.95 -43.41 98.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.021 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.736 HD13 ' O ' ' A' ' 186' ' ' ARG . 9.7 mp -63.26 -44.21 95.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 62.5 mttp -67.87 -40.0 83.64 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -68.66 -50.56 50.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.839 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.592 ' HZ2' ' HA ' ' A' ' 190' ' ' LEU . 2.6 pttm -67.09 -42.93 83.79 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.202 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.751 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.74 -37.84 76.62 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.47 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.508 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 11.6 mmm180 -63.4 -39.87 95.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 58.1 m -62.02 -42.59 99.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.77 -44.09 96.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.786 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -62.78 -40.98 99.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.522 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.58 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 95.2 mt-30 -62.03 -37.91 86.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.293 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.82 -41.48 98.82 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 201' ' ' LEU . 26.7 mt -63.82 -40.56 96.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.009 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -61.91 -38.17 87.39 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.413 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -63.45 -42.63 98.64 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.678 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.2 mt -60.56 -40.15 90.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.354 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -64.19 -43.08 96.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.062 179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.732 ' O ' ' N ' ' A' ' 210' ' ' GLN . 95.8 mtt-85 -63.14 -44.67 94.9 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.228 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.7 OUTLIER -64.39 -38.17 81.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.754 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 18.6 m -62.15 -35.7 79.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -103.89 -19.6 14.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.241 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.732 ' N ' ' O ' ' A' ' 206' ' ' ARG . 9.2 tt0 -115.84 -26.0 7.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -70.02 35.76 0.4 Allowed Glycine 0 CA--C 1.521 0.441 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.551 ' CG ' ' N ' ' A' ' 213' ' ' SER . 63.5 t80 -137.77 165.74 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.837 0.351 . . . . 0.0 110.652 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.551 ' N ' ' CG ' ' A' ' 212' ' ' TYR . 16.1 t -44.89 89.26 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.829 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 214' ' ' THR . . . . . 0.732 HG22 ' H ' ' A' ' 215' ' ' GLU . 27.7 m -138.35 175.28 9.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.459 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.732 ' H ' HG22 ' A' ' 214' ' ' THR . 44.8 tt0 -145.93 166.16 26.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.499 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 216' ' ' ALA . . . . . 0.55 ' N ' ' HG2' ' A' ' 215' ' ' GLU . . . 65.15 143.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.684 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -167.15 -15.02 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.939 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.511 ' C ' ' H ' ' A' ' 220' ' ' GLU . 75.0 m-85 -135.03 -170.86 2.66 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.286 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.5 ' O ' ' HG2' ' A' ' 219' ' ' GLU . 81.1 tt0 58.36 0.14 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.645 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.511 ' H ' ' C ' ' A' ' 218' ' ' PHE . 3.7 mp0 -34.86 151.04 0.07 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.663 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -76.2 47.83 2.13 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.488 2.125 . . . . 0.0 112.223 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.502 ' HE ' ' HA ' ' A' ' 222' ' ' ARG . 0.0 OUTLIER -125.86 -82.57 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.798 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.454 HG13 ' H ' ' A' ' 224' ' ' ILE . 0.3 OUTLIER -59.61 -53.37 49.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.495 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.7 OUTLIER -62.09 -34.96 66.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.356 0.598 . . . . 0.0 109.495 -179.467 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -65.91 -36.39 83.24 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.66 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.34 -43.06 92.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.61 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 43.4 m0 -62.42 -37.85 87.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.738 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -58.75 -40.61 84.37 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 231' ' ' GLN . 89.2 mt -62.96 -42.39 99.81 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.75 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.726 ' O ' HD11 ' A' ' 235' ' ' LEU . . . -38.96 -27.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 229' ' ' LEU . 17.4 tt0 -60.47 -42.44 96.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.634 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.8 m -125.64 61.66 1.23 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.655 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -127.73 -70.79 0.69 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.551 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -173.31 89.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.846 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.726 HD11 ' O ' ' A' ' 230' ' ' ALA . 0.1 OUTLIER -136.01 -156.13 0.69 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.68 -179.679 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 168.49 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.499 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -59.69 -54.55 45.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.858 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.43 -41.77 93.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.172 0.511 . . . . 0.0 110.558 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -59.43 -34.27 72.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.201 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 240' ' ' LEU . 0.1 OUTLIER -62.11 -43.25 99.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.793 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -65.85 -50.6 63.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.535 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.72 89.33 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.132 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.47 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -65.02 -42.13 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.329 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -54.69 -52.93 60.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.983 0.42 . . . . 0.0 110.434 -179.162 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -65.61 -38.84 90.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.92 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -57.41 -54.14 50.24 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.364 0.602 . . . . 0.0 110.616 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 247' ' ' LEU . 4.6 mm? -63.05 -37.13 85.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.534 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.558 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 43.3 tttp -55.32 -43.0 74.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 110.223 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -70.18 -39.3 75.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.334 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -60.65 -49.29 78.1 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.29 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.597 ' OE1' ' N ' ' A' ' 252' ' ' ALA . 0.1 OUTLIER -62.09 -39.4 92.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 252' ' ' ALA . . . . . 0.597 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.14 -37.32 85.41 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.536 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -62.74 -48.4 79.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.053 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -37.98 81.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.309 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -59.18 -47.13 86.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.511 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -63.21 -43.34 98.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.293 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 257' ' ' HIS . . . . . 0.404 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -58.2 -43.81 87.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.361 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 258' ' ' ASN . . . . . 0.421 ' OD1' ' C ' ' A' ' 258' ' ' ASN . 43.4 t-20 -61.14 -41.54 96.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.344 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 34.5 t-80 -60.58 -48.56 81.24 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.1 0.476 . . . . 0.0 110.529 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -62.7 -34.56 77.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.397 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -62.62 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.219 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.32 -47.72 83.0 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.087 0.47 . . . . 0.0 109.903 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.58 -37.19 86.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.936 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 61.7 tp -62.96 -42.36 99.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.198 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -61.82 -48.82 78.88 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.508 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.29 -42.77 96.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.012 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.91 83.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.153 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -62.85 -48.43 79.06 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.408 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -59.91 -46.12 90.36 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 110.473 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.36 -40.65 95.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.364 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.415 HD13 ' CB ' ' A' ' 286' ' ' SER . 33.8 tp -59.73 -43.35 94.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.086 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -59.82 -44.14 94.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.12 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -68.15 -40.7 82.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.727 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.578 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.11 -37.04 83.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.728 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 275' ' ' GLU . . . . . 0.666 ' OE2' HG13 ' A' ' 283' ' ' VAL . 62.1 mm-40 -55.11 -19.56 7.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.871 0.367 . . . . 0.0 110.619 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 71.1 m -76.58 -11.46 59.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.613 HG13 ' N ' ' A' ' 278' ' ' GLY . 7.9 p -63.06 -46.91 94.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.686 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.613 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 79.95 -13.3 25.86 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 279' ' ' ASP . . . . . 0.475 ' H ' HG13 ' A' ' 277' ' ' VAL . 81.3 m-20 -76.65 -11.6 59.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.782 0.325 . . . . 0.0 110.608 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 280' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 65.01 -140.35 41.83 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 60.72 -71.87 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.893 0.378 . . . . 0.0 110.598 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 282' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 280' ' ' GLY . 55.2 ttt85 -60.94 -33.51 73.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.416 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 283' ' ' VAL . . . . . 0.666 HG13 ' OE2' ' A' ' 275' ' ' GLU . 42.7 t -59.78 -45.65 94.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.548 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 45.6 t -61.16 -47.42 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.979 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.05 -47.3 80.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.922 0.391 . . . . 0.0 111.037 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 286' ' ' SER . . . . . 0.415 ' CB ' HD13 ' A' ' 271' ' ' LEU . 44.4 m -59.93 -43.31 95.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.685 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -63.91 -40.63 96.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -58.79 -59.11 5.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.322 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.66 ' HD3' HD23 ' A' ' 292' ' ' LEU . 21.3 mmtm -63.96 -40.93 97.54 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.956 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -44.65 -53.96 6.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.16 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.4 -35.43 79.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.438 179.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.66 HD23 ' HD3' ' A' ' 289' ' ' LYS . 20.8 tp -60.39 -50.22 74.47 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.322 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.36 -42.08 98.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.303 0.573 . . . . 0.0 109.936 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.501 ' O ' ' OG1' ' A' ' 297' ' ' THR . 16.2 tm-20 -62.0 -39.71 93.16 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.955 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.91 -40.91 99.86 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 7.9 tpp180 -61.73 -43.73 98.28 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.323 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.501 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 44.0 p -60.42 -43.85 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.263 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -62.78 -43.92 97.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.461 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -61.5 -42.02 98.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.283 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -44.59 96.46 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.412 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.26 -44.89 93.21 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -62.15 -41.98 98.81 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.115 0.483 . . . . 0.0 110.462 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 303' ' ' THR . . . . . 0.423 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 19.3 m -60.52 -44.5 95.97 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.424 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -61.26 -42.35 93.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.896 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -56.98 -48.33 78.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.075 0.465 . . . . 0.0 110.313 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.34 -41.55 98.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.694 179.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.423 ' ND1' ' O ' ' A' ' 303' ' ' THR . 37.4 m80 -65.01 -36.47 84.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.239 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.61 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 6.0 mt -62.38 -44.84 95.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.835 0.35 . . . . 0.0 110.34 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -69.86 -42.87 72.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.472 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -64.19 -45.23 89.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.791 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 23.1 mt -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.741 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 95.4 p -61.94 -38.49 88.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.357 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.57 -42.9 95.36 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.449 ' O ' HD21 ' A' ' 323' ' ' LEU . 66.8 mtp180 -66.1 -67.32 0.45 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.761 0.315 . . . . 0.0 110.879 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.585 ' O ' ' N ' ' A' ' 317' ' ' ARG . 4.8 mt -53.02 -94.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 316' ' ' SER . . . . . 0.549 ' C ' ' O ' ' A' ' 315' ' ' ILE . 6.6 t 25.08 -88.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.914 0.388 . . . . 0.0 110.575 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 315' ' ' ILE . 55.4 ttp180 -62.75 -47.52 83.17 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.559 ' N ' ' O ' ' A' ' 315' ' ' ILE . . . 28.59 61.32 0.13 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.38 0.61 . . . . 0.0 109.713 -177.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.528 HH21 ' C ' ' A' ' 323' ' ' LEU . 20.4 ptt180 -42.11 -101.94 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.234 -0.893 . . . . 0.0 112.239 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 320' ' ' HIS . . . . . 0.482 ' H ' ' HG3' ' A' ' 319' ' ' ARG . 15.3 p80 -141.75 18.07 2.16 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.301 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.512 ' O ' ' N ' ' A' ' 323' ' ' LEU . 27.7 t-20 -151.79 169.3 22.56 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.371 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.502 ' O ' ' HG2' ' A' ' 322' ' ' GLU . 79.2 tt0 -67.21 44.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.133 0.492 . . . . 0.0 109.784 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.533 ' N ' HD12 ' A' ' 323' ' ' LEU . 8.9 mp . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 117.914 -1.041 . . . . 0.0 110.618 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.4 m -128.55 151.04 49.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.476 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -142.83 153.95 43.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.451 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -150.35 141.08 22.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.828 0.347 . . . . 0.0 110.391 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -133.18 146.84 51.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.149 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -82.61 162.93 21.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.474 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.737 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 7.0 tt0 -171.38 -41.51 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.185 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.737 ' HD2' ' H ' ' A' ' 7' ' ' GLN . 86.4 Cg_endo -87.97 -96.09 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 122.726 2.284 . . . . 0.0 112.467 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.8 tptm 53.87 69.91 1.98 Allowed Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.228 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -66.78 -24.42 47.08 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.681 2.254 . . . . 0.0 112.263 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.7 m 46.79 80.05 0.31 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.405 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.89 161.14 44.44 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.757 2.304 . . . . 0.0 112.115 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -64.29 148.7 49.66 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.236 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -144.99 167.66 22.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.6 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -104.04 160.71 14.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.495 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.7 p -68.6 163.52 23.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.543 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.48 82.17 0.04 OUTLIER Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -143.0 107.67 4.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.744 0.306 . . . . 0.0 110.284 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -69.63 -40.53 76.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.803 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -102.09 -178.82 3.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.726 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.488 HH12 HD22 ' A' ' 57' ' ' LEU . 90.0 mtm180 -93.75 6.01 49.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.364 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.519 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 10.0 tpt -144.88 130.07 18.58 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -60.95 -38.29 85.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.357 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.8 -47.97 81.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.569 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 25' ' ' LEU . 95.6 mt -61.5 -38.63 88.05 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.727 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.519 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.4 m-80 -64.18 -40.13 95.46 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.488 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -60.77 -49.58 76.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.74 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.469 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 3.6 mm? -61.92 -40.88 97.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.215 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 47.7 t-105 -61.84 -46.26 90.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.134 0.492 . . . . 0.0 110.423 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -57.59 -42.85 83.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.462 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -61.6 -42.78 99.36 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.99 -44.69 87.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.162 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.172 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -60.2 -43.48 95.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.142 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.9 mt -65.01 -36.87 85.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.261 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.85 110.37 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.741 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.8 mt -127.33 155.81 75.87 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.806 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -40.94 154.42 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.535 2.157 . . . . 0.0 112.189 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.71 -47.14 26.88 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.548 2.165 . . . . 0.0 112.556 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.25 -45.08 97.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.412 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.539 ' O ' HD13 ' A' ' 45' ' ' LEU . 22.2 mmt85 -63.86 -40.59 96.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.53 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 tp -62.54 -43.71 98.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.529 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.98 89.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.412 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -67.9 -48.56 65.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 41' ' ' ARG . 8.1 mp -62.98 -45.46 92.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.646 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -63.8 -44.11 94.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.851 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.631 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.18 -48.73 80.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.071 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -57.43 -46.89 83.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.926 0.393 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.13 -40.84 86.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.917 0.389 . . . . 0.0 110.046 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.22 -39.91 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.088 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.631 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.9 mm -62.3 -43.78 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.054 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -58.62 -45.32 89.45 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.542 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.34 -47.01 87.03 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.128 0.489 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -64.16 -39.56 94.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.684 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.426 ' C ' ' OD1' ' A' ' 55' ' ' ASP . 60.4 t0 -60.56 -43.46 97.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.597 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -61.72 -43.88 97.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.033 0.444 . . . . 0.0 110.135 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.488 HD22 HH12 ' A' ' 21' ' ' ARG . 52.1 tp -60.5 -41.74 94.91 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.199 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.3 99.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.605 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.8 -42.41 93.36 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.342 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -61.08 -45.45 94.67 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -57.84 -44.02 86.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.179 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.9 mt -61.92 -42.11 98.72 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.139 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -56.26 -47.05 79.3 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.27 -0.572 . . . . 0.0 109.639 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.3 mt -64.55 -37.59 88.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.946 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -61.83 -20.63 63.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.834 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.8 32.82 5.24 Favored Glycine 0 C--N 1.335 0.513 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 179.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 94.3 mt -123.35 -164.42 1.21 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.257 0.551 . . . . 0.0 110.333 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 61.79 95.32 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.44 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -127.6 -32.54 2.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.835 0.35 . . . . 0.0 110.475 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -65.33 -39.21 92.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.653 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 85.22 -0.17 88.72 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -64.31 -35.13 79.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.701 0.286 . . . . 0.0 110.275 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.409 ' O ' HD13 ' A' ' 77' ' ' LEU . 65.7 mttm -58.04 -59.8 4.72 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.129 0.49 . . . . 0.0 110.162 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -55.57 -41.48 73.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.283 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.685 ' HB1' ' NH1' ' A' ' 79' ' ' ARG . . . -61.2 -38.67 87.37 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.352 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -62.49 -42.94 99.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 73' ' ' LYS . 10.2 mp -62.47 -43.08 99.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.49 -47.52 91.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.215 0.531 . . . . 0.0 110.134 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.685 ' NH1' ' HB1' ' A' ' 75' ' ' ALA . 77.3 mtt85 -61.21 -41.22 96.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.218 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.436 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.58 -49.26 78.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.082 0.468 . . . . 0.0 110.346 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.07 -38.54 88.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 79' ' ' ARG . 48.1 t -62.14 -47.05 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.636 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.8 -49.35 84.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.436 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.476 HD21 ' HA ' ' A' ' 91' ' ' ASP . 13.7 tp -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.035 0.445 . . . . 0.0 110.724 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.84 93.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.849 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -61.63 -48.38 81.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.435 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -76.25 -16.31 59.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.12 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 58.51 38.42 91.03 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 90' ' ' LEU . 39.5 mt -102.09 14.98 30.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 110.547 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.476 ' HA ' HD21 ' A' ' 85' ' ' LEU . 47.2 t0 -57.05 -48.02 79.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.594 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.55 154.17 22.81 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 14.8 mmmt -140.56 -85.56 0.2 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.763 0.316 . . . . 0.0 110.715 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -161.6 137.2 7.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.584 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.86 156.52 41.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.875 0.369 . . . . 0.0 110.7 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -155.55 106.59 2.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.346 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 51.3 ptt85 -140.69 142.25 34.9 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.802 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.517 ' CD ' ' N ' ' A' ' 98' ' ' GLN . 2.1 pm0 -137.96 73.08 1.43 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.397 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 55.4 t -122.37 131.27 73.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.33 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.1 p -110.7 7.12 22.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.558 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 90.9 p -61.26 -35.69 77.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.345 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.583 ' O ' ' N ' ' A' ' 104' ' ' LEU . 50.6 p-10 -85.13 -26.56 26.8 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.521 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.521 ' N ' ' OD1' ' A' ' 102' ' ' ASN . 10.5 m 47.66 -84.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.819 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.583 ' N ' ' O ' ' A' ' 102' ' ' ASN . 0.6 OUTLIER 45.07 56.18 5.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.147 0.499 . . . . 0.0 110.266 -179.844 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.1 p -149.37 164.72 34.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.555 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.54 78.18 1.29 Allowed Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 42.6 p -63.07 -34.12 76.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.635 0.255 . . . . 0.0 110.524 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -60.21 125.17 22.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.164 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -126.37 135.75 51.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.763 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 39.4 p-10 -149.99 123.02 8.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.395 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -147.97 -111.45 0.63 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.51 ' O ' ' CG ' ' A' ' 118' ' ' GLU . 5.5 mp -111.03 138.74 47.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.84 0.353 . . . . 0.0 110.748 -179.569 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.55 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 97.0 m-20 -88.31 -26.78 22.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.623 179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -61.63 109.07 1.87 Allowed Pre-proline 0 C--N 1.331 -0.216 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' A' ' 113' ' ' ASP . 52.5 Cg_exo -52.6 -37.8 74.83 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 122.514 2.143 . . . . 0.0 112.526 -179.132 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 83.1 mtt85 -63.15 -45.32 92.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.11 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.19 -32.83 56.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.733 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.55 ' OE2' ' O ' ' A' ' 113' ' ' ASP . 39.6 mt-10 -58.44 -42.2 86.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.8 mttt -60.16 -42.55 95.16 Favored 'General case' 0 C--N 1.318 -0.761 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.435 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.4 mt -64.4 -47.44 79.18 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.068 0.461 . . . . 0.0 111.773 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.635 ' CZ2' HD13 ' A' ' 135' ' ' LEU . 10.2 t-105 -64.24 -44.78 90.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.592 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.434 ' ND1' ' O ' ' A' ' 118' ' ' GLU . 4.1 m80 -69.24 -34.98 75.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.745 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.554 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.4 mptt -60.25 -51.2 70.58 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.232 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -74.57 -46.31 39.63 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.722 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.45 ' HB2' HD11 ' A' ' 135' ' ' LEU . 62.9 tttp -53.21 -44.26 67.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.311 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -102.68 -60.08 1.6 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.935 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -61.65 -6.21 2.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.787 -178.986 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -135.65 4.41 4.0 Favored Glycine 0 C--N 1.329 0.174 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.486 ' CG ' ' O ' ' A' ' 128' ' ' GLY . 19.0 ptpt 43.44 21.09 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.17 0.509 . . . . 0.0 109.84 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.495 ' N ' ' O ' ' A' ' 128' ' ' GLY . 32.8 m-85 -78.78 50.75 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.586 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.7 p -94.5 130.11 41.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 112.105 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.13 -98.72 1.33 Allowed Glycine 0 CA--C 1.534 1.267 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.869 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.446 ' HG2' ' H ' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -80.3 -43.64 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.049 -179.226 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 133' ' ' GLU . 67.8 mm-40 -64.96 -42.96 94.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.635 HD13 ' CZ2' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.79 -43.51 98.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.942 179.445 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -62.3 -39.29 92.51 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.952 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -60.41 -43.29 96.87 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.37 0.605 . . . . 0.0 109.852 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 134' ' ' GLU . 2.8 mm? -59.68 -43.84 93.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -36.92 85.65 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.013 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.55 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 88.7 mtt-85 -53.49 -41.51 66.33 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.542 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 0.4 OUTLIER -71.26 -43.36 67.36 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.853 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -58.47 -54.86 42.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.407 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.49 -38.91 89.04 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.309 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 1.8 m-70 -54.75 -42.79 72.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.613 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -66.31 -39.8 89.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.637 178.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -61.27 -47.25 86.87 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.379 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.8 pt-20 -71.49 -43.01 67.33 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.541 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.417 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 96.9 mttt -62.67 -44.13 97.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.797 0.332 . . . . 0.0 110.456 -179.578 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.9 t -64.4 -44.43 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.603 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.776 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -60.63 -39.58 88.75 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.43 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.81 -43.18 99.48 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.678 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.584 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 24.5 m-85 -65.45 -49.63 68.43 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.842 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -68.62 -42.26 78.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.023 0.44 . . . . 0.0 110.997 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 150' ' ' HIS . 73.2 t -63.03 -45.16 99.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.947 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.5 mt -63.58 -45.7 89.22 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.761 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -64.0 -42.19 97.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.564 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -69.68 -31.09 68.94 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.167 178.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' THR . . . . . 0.517 ' HA ' HH21 ' A' ' 161' ' ' ARG . 64.0 m -64.34 -51.55 62.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.174 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 160' ' ' SER . 1.8 pp -72.01 -34.4 68.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.807 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.514 ' N ' HD12 ' A' ' 159' ' ' LEU . 74.5 m -60.51 -43.18 97.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.788 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.517 HH21 ' HA ' ' A' ' 158' ' ' THR . 88.6 mtm180 -63.39 -47.54 81.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.314 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.708 ' C ' ' H ' ' A' ' 164' ' ' GLU . 13.0 p -91.34 175.01 7.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.557 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 61.43 -18.78 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.045 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.708 ' H ' ' C ' ' A' ' 162' ' ' THR . 32.5 tt0 -109.3 42.22 1.49 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.4 tt -135.07 141.14 43.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.085 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.425 ' O ' ' CG ' ' A' ' 167' ' ' GLU . 0.3 OUTLIER -172.13 25.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.791 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 166' ' ' HIS . 18.4 pt-20 43.76 25.45 0.09 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.975 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -171.36 121.9 0.53 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.591 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 43.4 t -130.19 94.01 2.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.489 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.516 HG23 ' O ' ' A' ' 170' ' ' ILE . 19.8 tt -171.0 125.23 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.56 160.92 5.0 Favored Pre-proline 0 N--CA 1.453 -0.312 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.13 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -50.68 128.28 23.51 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 122.312 2.008 . . . . 0.0 111.788 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 51.0 p -154.78 161.23 41.58 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.495 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -160.12 -28.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.426 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 36.0 tp -84.89 102.13 12.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.934 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 6.4 m 43.99 26.05 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.469 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 60.27 27.52 17.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.632 HD12 ' O ' ' A' ' 178' ' ' ILE . 2.5 pp -141.89 165.47 17.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.531 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -72.3 139.13 47.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.411 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -103.89 131.25 10.56 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.472 ' O ' ' NE2' ' A' ' 184' ' ' HIS . 1.9 m 174.9 -74.2 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.804 0.335 . . . . 0.0 110.504 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.67 ' O ' HG12 ' A' ' 182' ' ' VAL . 64.8 t -128.14 7.56 3.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.069 0.462 . . . . 0.0 110.573 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.84 -40.87 94.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.464 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.514 ' CD2' ' H ' ' A' ' 184' ' ' HIS . 6.9 p80 -53.7 -43.74 69.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.578 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 41.7 t -60.26 -44.06 95.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.196 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.549 ' O ' HD13 ' A' ' 190' ' ' LEU . 99.3 mtt180 -60.77 -45.57 93.81 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.098 -179.588 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -61.25 -39.91 92.09 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.291 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.9 m -61.11 -44.41 97.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.246 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -58.81 -40.34 83.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.971 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.549 HD13 ' O ' ' A' ' 186' ' ' ARG . 8.5 mp -63.18 -41.06 99.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.459 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.546 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 67.5 mttm -67.35 -34.06 76.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.59 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 97.2 mt-10 -67.6 -50.28 58.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.584 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 10.6 ptmt -72.28 -44.7 62.39 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.358 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.769 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.95 -41.51 86.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.102 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.546 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -65.92 -36.88 84.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 55.6 m -61.56 -43.38 98.97 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.42 -44.12 97.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.849 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.439 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.3 m-20 -62.0 -42.05 98.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.582 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.477 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 14.9 mm100 -62.24 -38.59 89.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.381 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.4 -42.3 99.74 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 201' ' ' LEU . 18.3 mt -63.25 -41.97 99.12 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.235 179.058 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.498 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.1 OUTLIER -62.8 -36.64 83.8 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -63.92 -42.27 97.43 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.616 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.48 -39.43 90.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.409 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -62.04 -45.12 94.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.222 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.554 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.7 mtt180 -65.3 -36.58 84.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.16 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.51 -45.88 96.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.252 0.548 . . . . 0.0 110.279 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 80.6 p -72.37 -26.67 61.98 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.535 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -95.34 -14.58 23.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.513 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -146.11 -25.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.718 0.294 . . . . 0.0 111.109 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -73.06 33.7 0.76 Allowed Glycine 0 CA--C 1.518 0.271 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.52 ' H ' ' C ' ' A' ' 210' ' ' GLN . 68.9 t80 -60.76 -47.47 86.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.786 0.327 . . . . 0.0 110.37 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 174.79 85.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.407 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 33.5 p -134.39 165.15 25.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.501 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -140.42 140.65 35.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.715 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.63 143.23 44.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.507 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.442 ' O ' ' C ' ' A' ' 218' ' ' PHE . 11.8 mt-10 -158.64 34.04 0.23 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.247 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.569 ' O ' ' C ' ' A' ' 219' ' ' GLU . 33.7 m-85 -33.81 97.27 0.01 OUTLIER 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.426 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.569 ' C ' ' O ' ' A' ' 218' ' ' PHE . 2.2 tm-20 36.19 -139.38 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -178.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 59.3 mt-10 -87.26 148.97 46.05 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.163 176.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.75 81.93 1.27 Allowed 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.564 2.176 . . . . 0.0 112.146 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 175.98 -36.6 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.752 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.916 HG13 ' H ' ' A' ' 224' ' ' ILE . 1.5 p -68.92 -76.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.168 0.508 . . . . 0.0 110.698 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.916 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.2 mp -50.61 -26.65 4.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.132 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -67.01 -50.03 63.43 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.371 0.605 . . . . 0.0 109.943 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 12.3 tp -56.79 -37.41 71.1 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 44.8 m0 -63.96 -42.56 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.193 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 228' ' ' ASP . . . . . 0.507 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 97.1 m-20 -66.76 -18.44 65.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 1.7 mt -77.81 -44.61 26.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.061 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 232' ' ' SER . . . -36.68 -62.16 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.198 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.507 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 3.2 pt20 -38.39 -31.94 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.673 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.413 ' N ' ' O ' ' A' ' 230' ' ' ALA . 66.5 m -118.4 52.62 1.01 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.374 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -141.41 46.26 1.71 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 61.95 72.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.379 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 235' ' ' LEU . 20.0 mt -125.08 148.04 48.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.696 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 66.6 p -66.36 -165.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.463 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 237' ' ' ASP . . . . . 0.548 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 31.3 p-10 -95.84 -48.18 5.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 238' ' ' LYS . . . . . 0.548 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 97.9 mttt -62.58 -43.35 99.03 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.03 0.443 . . . . 0.0 110.675 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -64.68 -33.63 76.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.013 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.67 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -62.56 -43.49 98.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.306 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -65.12 -49.66 69.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.405 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.14 -39.91 91.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.089 0.471 . . . . 0.0 110.002 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.486 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.14 -44.11 93.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.103 179.033 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 244' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 244' ' ' ARG . 0.0 OUTLIER -60.03 -47.55 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.036 0.445 . . . . 0.0 110.193 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -65.62 -47.43 75.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.751 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -56.28 -50.94 69.93 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.495 0.664 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.6 mm? -63.43 -37.82 88.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.776 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.452 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 89.0 tttt -53.76 -45.38 70.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.391 0.615 . . . . 0.0 109.995 -179.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -67.48 -40.63 85.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.697 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -61.01 -48.98 79.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.638 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.452 ' CG ' ' O ' ' A' ' 248' ' ' LYS . 13.5 pt-20 -59.31 -38.16 79.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 252' ' ' ALA . . . . . 0.422 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -65.48 -38.17 88.98 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.521 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -62.9 -49.57 74.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.554 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 9.7 tt -64.97 -31.84 55.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.17 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -62.22 -46.36 89.22 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.214 0.53 . . . . 0.0 110.054 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.22 -42.48 99.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.973 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -56.42 -43.83 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.339 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -61.93 -40.79 96.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.118 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -57.03 -46.33 82.45 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.274 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -63.7 -37.4 87.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 261' ' ' GLN . . . . . 0.513 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 30.8 mm-40 -57.72 -48.72 78.79 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.35 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -62.28 -43.1 99.61 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.189 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -65.49 -35.42 80.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.973 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 39.4 tp -63.7 -43.85 95.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.42 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -64.21 -44.72 91.06 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.542 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.44 -42.93 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.089 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.61 87.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.361 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -62.02 -48.52 79.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -61.61 -46.69 88.78 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 110.66 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.78 -37.66 85.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.349 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 49.3 tp -61.82 -43.99 97.74 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -61.59 -43.0 99.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.41 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -72.13 -37.69 69.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.61 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -63.1 -37.12 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.862 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.7 -30.77 71.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.715 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 90.7 p -86.71 2.43 48.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.712 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 274' ' ' ALA . 9.5 p -60.74 -41.97 90.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.455 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.514 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 123.73 -57.45 0.65 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -96.74 111.35 23.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.803 0.335 . . . . 0.0 110.584 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -74.08 106.93 2.13 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -136.6 -21.08 1.32 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.311 . . . . 0.0 110.651 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -124.81 -4.22 7.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.705 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 283' ' ' VAL . . . . . 0.57 HG13 ' N ' ' A' ' 284' ' ' SER . 11.3 p -63.24 -46.04 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 284' ' ' SER . . . . . 0.57 ' N ' HG13 ' A' ' 283' ' ' VAL . 10.6 t -63.78 -49.34 73.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.075 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.53 -43.03 98.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.86 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 48.5 t -60.27 -44.56 95.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.52 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 287' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 290' ' ' HIS . 60.0 ttt85 -63.24 -41.05 99.04 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.228 0.537 . . . . 0.0 110.632 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -56.81 -57.51 12.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.252 0.548 . . . . 0.0 109.959 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.564 ' HD3' HD23 ' A' ' 292' ' ' LEU . 46.8 mmtt -64.54 -31.34 72.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.153 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 290' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 287' ' ' ARG . 52.0 t-80 -53.13 -49.93 65.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.29 -37.62 71.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.618 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.564 HD23 ' HD3' ' A' ' 289' ' ' LYS . 26.3 tp -61.46 -50.76 71.46 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.594 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.3 mp -63.82 -41.65 97.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.135 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.16 -40.46 97.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.323 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.69 -47.21 91.8 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -63.66 -37.45 87.39 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.51 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.513 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 8.3 m -60.23 -50.27 74.31 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.488 -179.202 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.41 -40.07 96.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.412 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -58.93 -45.47 90.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.358 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.46 -44.51 96.98 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.297 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.36 -43.56 84.74 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 302' ' ' TYR . . . . . 0.475 ' CE1' ' NZ ' ' A' ' 306' ' ' LYS . 49.3 t80 -62.25 -42.43 99.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.162 0.506 . . . . 0.0 110.489 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 303' ' ' THR . . . . . 0.454 HG22 ' ND1' ' A' ' 307' ' ' HIS . 17.2 m -60.48 -44.29 96.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.643 -179.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.31 -43.25 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.046 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.79 -49.44 76.61 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.045 0.45 . . . . 0.0 110.937 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 306' ' ' LYS . . . . . 0.475 ' NZ ' ' CE1' ' A' ' 302' ' ' TYR . 34.7 mmtm -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.805 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.454 ' ND1' HG22 ' A' ' 303' ' ' THR . 20.6 m80 -66.31 -31.25 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.921 179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.65 HD21 ' CG2' ' A' ' 223' ' ' VAL . 0.5 OUTLIER -61.12 -49.92 75.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.238 -179.706 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -69.71 -40.1 76.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.634 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -60.05 -51.17 70.76 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.885 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 311' ' ' LEU . 30.2 mt -63.25 -39.82 95.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.442 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.7 t -58.89 -43.41 90.94 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.685 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.9 -49.89 56.1 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.741 ' HE ' ' N ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.93 -43.6 95.4 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.7 mm -64.34 -43.14 97.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.809 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 99.5 p -56.07 -34.55 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.864 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 14.3 tpp180 -69.67 -75.53 0.11 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.493 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 47.97 84.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.1 -178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -78.14 -164.01 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.15 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 45.4 m170 -42.42 -67.76 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.244 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.467 ' O ' ' OD1' ' A' ' 321' ' ' ASN . 36.6 p-10 -136.97 118.31 14.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.782 0.325 . . . . 0.0 110.514 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 321' ' ' ASN . 84.9 tt0 56.83 152.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.493 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.491 HD22 ' N ' ' A' ' 323' ' ' LEU . 4.2 mm? . . . . . 0 C--O 1.221 -0.42 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.235 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.5 p -140.31 132.4 27.93 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.474 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.631 HH12 ' CE ' ' A' ' 5' ' ' LYS . 70.6 ttt-85 -85.66 -34.6 21.29 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.508 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.472 ' HG2' ' N ' ' A' ' 5' ' ' LYS . 69.8 tt0 78.02 -121.21 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.851 179.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.631 ' CE ' HH12 ' A' ' 3' ' ' ARG . 7.6 ttpt 49.36 30.69 3.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.644 -179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.471 ' O ' ' O ' ' A' ' 5' ' ' LYS . 89.3 m-20 39.95 -165.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -165.41 145.64 5.73 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.154 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.13 157.7 58.83 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.404 2.069 . . . . 0.0 112.321 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.673 ' H ' ' HD2' ' A' ' 10' ' ' PRO . 4.7 mtpm? -137.54 -60.89 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.335 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.134 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.673 ' HD2' ' H ' ' A' ' 9' ' ' LYS . 83.4 Cg_exo -36.35 143.64 0.11 Allowed 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.571 2.18 . . . . 0.0 112.424 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.15 172.58 7.06 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.813 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -62.51 145.85 95.48 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.976 2.45 . . . . 0.0 112.171 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -131.05 144.6 51.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.52 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 80.8 mtp85 -135.41 144.72 46.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.314 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 58.29 111.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.441 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.9 m -121.92 122.07 38.54 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.621 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -94.43 157.58 22.55 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -173.03 110.13 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.48 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 56.3 mp0 -93.88 -24.36 17.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.901 0.381 . . . . 0.0 110.556 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -133.91 162.06 33.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.728 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp85 -77.4 -11.48 59.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.69 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -134.83 145.7 48.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 110.988 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.35 -33.65 76.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.722 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.4 ' O ' HD23 ' A' ' 28' ' ' LEU . 58.1 mttm -59.02 -47.23 85.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 109.887 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.467 ' N ' HD12 ' A' ' 25' ' ' LEU . 9.4 mp -64.13 -37.94 89.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.292 178.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -63.79 -41.24 97.96 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.602 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -65.15 -45.12 86.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.107 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.409 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 1.6 mm? -63.36 -41.78 98.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.479 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -63.29 -47.81 80.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.09 0.472 . . . . 0.0 110.358 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.5 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 80.8 tt0 -60.83 -39.19 88.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.199 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -45.0 96.38 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.06 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -41.36 96.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -59.45 -40.05 85.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.027 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.5 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -64.57 -39.01 92.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.339 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.4 mt -63.54 -36.73 84.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.383 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 65.95 106.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.604 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -129.4 154.47 80.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.63 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 74.3 Cg_exo -43.95 153.77 0.28 Allowed 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.369 2.046 . . . . 0.0 112.528 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.4 Cg_exo -58.73 -41.05 67.31 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.681 2.254 . . . . 0.0 112.364 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.01 -49.12 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.852 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.74 -41.57 92.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.622 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -65.25 -42.36 93.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -51.71 64.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.176 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.01 -38.48 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.504 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.9 tp -62.16 -50.77 70.51 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.043 0.449 . . . . 0.0 110.621 -179.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -61.1 -40.82 95.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.21 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.615 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.29 -49.77 75.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.073 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -58.82 -46.03 88.58 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.996 0.427 . . . . 0.0 110.584 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.0 mt -59.93 -41.07 90.95 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -58.99 -38.79 80.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.145 178.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 47' ' ' ALA . 45.5 mm -62.16 -44.42 99.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -58.81 -43.96 90.69 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.606 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.97 -48.37 81.79 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.971 0.415 . . . . 0.0 110.453 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -60.25 -44.54 95.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.752 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.94 -40.66 94.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.505 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.07 -45.74 91.9 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 110.103 179.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.31 -42.97 99.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.966 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.83 96.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.557 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.2 t90 -58.52 -44.08 89.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.095 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.77 -46.5 90.21 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 120.624 -0.43 . . . . 0.0 109.914 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.11 -41.05 97.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.085 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.449 HD13 ' HZ2' ' A' ' 73' ' ' LYS . 79.7 mt -61.62 -41.2 97.14 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.45 -38.74 88.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.667 ' O ' HD23 ' A' ' 64' ' ' LEU . 3.1 tt -60.88 -43.69 98.11 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.87 -35.03 79.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.43 179.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.48 36.96 4.16 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 111.263 -0.735 . . . . 0.0 111.263 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 88.7 mt -96.55 -69.19 0.77 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.75 0.309 . . . . 0.0 110.649 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.469 ' O ' ' OD1' ' A' ' 68' ' ' ASP . 16.2 p30 -63.26 142.52 58.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.472 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -160.36 -26.42 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.528 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -68.16 -27.44 66.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.461 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.9 8.91 83.54 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.02 -40.69 91.29 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.573 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.449 ' HZ2' HD13 ' A' ' 62' ' ' LEU . 39.7 mtpt -62.49 -47.81 82.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.021 0.439 . . . . 0.0 110.362 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.99 -42.55 94.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.467 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.84 -40.28 94.77 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -62.25 -41.97 98.92 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.608 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.52 -43.8 96.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.444 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.77 -45.66 94.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.302 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.776 ' O ' HG23 ' A' ' 83' ' ' VAL . 92.1 mtt-85 -63.09 -41.29 99.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.992 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -64.03 -39.59 94.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.337 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.587 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -60.16 -51.39 69.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.901 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.436 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 60.7 t-20 -66.23 -38.91 89.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.705 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 79' ' ' ARG . 60.8 t -62.29 -47.46 92.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.691 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.9 -47.11 94.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.63 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 85' ' ' LEU . 11.6 tp -66.23 -41.11 90.51 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.638 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.59 -47.62 84.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.989 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -62.64 -44.8 95.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 110.404 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -63.65 -32.74 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.065 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 79.46 22.61 64.43 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.8 mt -98.11 14.92 25.88 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.886 0.374 . . . . 0.0 110.338 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -60.89 -43.78 98.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.693 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 150.89 -116.72 0.79 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.8 tttt 60.93 124.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.006 0.432 . . . . 0.0 110.301 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -104.62 133.14 49.97 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.935 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -93.21 -35.48 13.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.743 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 56.99 78.83 0.21 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.888 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -128.6 -72.85 0.6 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.364 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 63.0 tp60 57.95 103.04 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.788 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.4 ' O ' HG13 ' A' ' 99' ' ' VAL . 8.1 p -126.44 131.89 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.536 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -87.27 -25.84 23.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.747 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.2 t -69.2 152.73 44.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.613 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -126.39 168.9 13.54 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.606 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 69.4 p 45.29 50.4 9.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.479 HD22 ' N ' ' A' ' 104' ' ' LEU . 4.4 mm? -62.22 -43.19 99.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.506 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.1 m -160.87 -46.45 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.563 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.48 95.57 1.71 Allowed Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.6 m -61.1 -44.45 97.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.756 0.312 . . . . 0.0 110.814 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 55.39 78.46 0.19 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.743 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -72.09 -38.96 69.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.86 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -85.35 167.16 15.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.811 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -137.3 -78.36 0.08 OUTLIER Glycine 0 CA--C 1.523 0.579 0 N-CA-C 111.096 -0.801 . . . . 0.0 111.096 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.4 mt -112.36 141.74 45.72 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -119.73 -84.64 0.66 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.699 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -58.13 144.13 77.04 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.656 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.1 -20.91 43.44 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.419 2.079 . . . . 0.0 112.16 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -65.23 -38.97 92.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.934 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.1 mp -85.78 -27.19 25.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.863 0.364 . . . . 0.0 110.778 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -59.5 -44.02 93.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 20.3 pttp -60.6 -41.5 94.89 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.257 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.429 ' N ' ' CG ' ' A' ' 119' ' ' LYS . 11.8 mt -62.12 -44.92 95.59 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.638 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.578 ' CZ3' HD22 ' A' ' 135' ' ' LEU . 15.6 t-105 -61.76 -47.16 86.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.318 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 3.0 m80 -67.68 -38.9 84.34 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.125 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.545 ' O ' ' CB ' ' A' ' 127' ' ' SER . 12.9 tptt -58.58 -51.45 69.83 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.911 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.04 -45.75 63.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.649 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.407 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 65.0 tttm -48.33 -44.45 34.19 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 128' ' ' GLY . 23.3 m -107.08 -60.54 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.818 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.71 -8.87 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.898 -178.958 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.556 ' C ' ' H ' ' A' ' 130' ' ' PHE . . . -137.58 4.38 3.34 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 48.92 11.03 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.135 0.493 . . . . 0.0 109.786 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.556 ' H ' ' C ' ' A' ' 128' ' ' GLY . 24.3 m-85 -71.58 50.45 0.18 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.421 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.47 ' HA ' HD12 ' A' ' 135' ' ' LEU . 4.7 p -97.94 112.9 24.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 112.145 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.44 -98.37 0.62 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.711 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.465 ' CG ' ' N ' ' A' ' 134' ' ' GLU . 10.0 pt-20 -77.18 -44.0 31.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.839 0.352 . . . . 0.0 111.31 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.465 ' N ' ' CG ' ' A' ' 133' ' ' GLU . 79.5 mm-40 -66.08 -41.92 90.05 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.578 HD22 ' CZ3' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.07 -43.18 99.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.862 179.373 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.513 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.3 OUTLIER -62.31 -37.99 87.68 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.936 179.769 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.434 ' N ' ' OD1' ' A' ' 136' ' ' ASP . 36.2 mmtm -60.15 -44.15 95.2 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.981 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.6 mm? -60.64 -43.03 98.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.34 -34.84 79.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 177.104 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -58.5 -39.09 79.09 Favored 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.988 178.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.489 ' OE1' HD21 ' A' ' 204' ' ' LEU . 97.4 mt-10 -70.62 -44.29 67.51 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.995 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -58.91 -56.29 24.18 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.74 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.785 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 97.4 mt -60.82 -39.84 90.53 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.579 -0.448 . . . . 0.0 109.815 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -55.19 -41.28 71.75 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.479 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -63.87 -45.88 87.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.384 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.785 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 46.7 pttt -57.55 -45.75 84.74 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.549 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.533 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 77.8 mm-40 -68.91 -50.18 51.7 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -63.09 -44.32 96.04 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.975 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 1.2 p -64.88 -38.09 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.716 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.3 m170 -65.92 -41.26 91.63 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.228 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.38 -43.16 95.37 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.939 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.52 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 3.8 m-85 -61.88 -50.84 70.62 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.853 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -69.77 -44.05 70.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.307 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 150' ' ' HIS . 74.2 t -63.4 -46.9 94.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.922 -179.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 74.0 mt -63.91 -48.48 76.44 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.401 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.698 ' C ' HD12 ' A' ' 156' ' ' LEU . 0.3 OUTLIER -65.87 -39.72 90.97 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.014 -179.88 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 157' ' ' GLU . . . . . 0.53 ' O ' ' OG ' ' A' ' 160' ' ' SER . 93.9 mt-10 -68.18 -30.69 69.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.321 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 61.2 m -66.16 -47.51 73.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.338 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.437 HD12 ' N ' ' A' ' 160' ' ' SER . 3.4 pp -77.56 -21.21 52.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.567 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 95.2 p -61.88 -24.58 67.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.728 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 -59.97 -45.58 92.23 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.038 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.44 24.46 3.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.018 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -114.25 -26.63 7.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.396 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -85.72 33.3 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.954 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.503 ' O ' HG23 ' A' ' 165' ' ' ILE . 16.6 tt -134.24 128.46 52.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.03 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 51.6 m80 -157.68 25.67 0.28 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.343 0.592 . . . . 0.0 109.553 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.537 ' O ' ' CG ' ' A' ' 168' ' ' ASN . 77.8 tt0 55.95 46.92 21.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.396 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.537 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 2.8 p-10 47.35 55.5 8.15 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.394 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 51.5 t -124.99 131.57 72.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.96 0.409 . . . . 0.0 110.584 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.0 tt -142.29 142.35 27.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.627 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' SER . . . . . 0.471 ' O ' ' N ' ' A' ' 173' ' ' SER . 0.3 OUTLIER -132.4 155.49 81.2 Favored Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.214 179.775 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -63.42 64.5 0.18 Allowed 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.586 2.191 . . . . 0.0 111.911 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.471 ' N ' ' O ' ' A' ' 171' ' ' SER . 3.9 m -158.45 121.97 3.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.925 0.393 . . . . 0.0 110.735 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -66.65 -40.53 88.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.428 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.583 ' O ' ' N ' ' A' ' 177' ' ' ASP . 93.0 mt -120.95 88.13 2.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.274 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 48.4 -84.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.276 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 175' ' ' LEU . 55.5 p30 -171.36 30.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.696 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.662 HD12 ' O ' ' A' ' 178' ' ' ILE . 1.6 pp -126.69 163.21 29.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.908 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -87.63 50.4 1.99 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.409 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 79.23 18.61 73.91 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 7.3 t -67.72 -22.22 65.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.788 0.327 . . . . 0.0 110.927 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.503 HG12 ' N ' ' A' ' 183' ' ' LEU . 9.0 t -133.67 165.55 31.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.645 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.734 ' CD1' HH21 ' A' ' 186' ' ' ARG . 0.9 OUTLIER 62.23 4.76 1.32 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.421 -179.87 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.654 ' ND1' ' N ' ' A' ' 185' ' ' SER . 5.7 p80 -65.64 -36.3 83.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.392 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.654 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 5.9 t -64.15 -46.26 84.83 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.462 -179.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.734 HH21 ' CD1' ' A' ' 183' ' ' LEU . 45.5 mtm-85 -66.59 -45.3 79.68 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.285 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -67.08 -43.46 82.51 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.338 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.4 m -63.69 -45.01 91.98 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.999 0.428 . . . . 0.0 110.23 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -67.34 -35.07 78.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.998 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.721 HD23 ' HZ1' ' A' ' 193' ' ' LYS . 14.2 mt -61.73 -45.55 93.43 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.083 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 55.9 pttt -80.45 -34.28 36.12 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.582 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 42.7 tt0 -69.24 -42.89 75.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.026 -179.33 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.721 ' HZ1' HD23 ' A' ' 190' ' ' LEU . 10.1 pttm -74.34 -43.2 57.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.745 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.3 OUTLIER -68.6 -40.01 80.65 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.873 -179.726 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.491 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.2 ptm180 -67.6 -39.62 84.78 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 75.5 p -60.49 -40.79 92.58 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -64.93 -43.42 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.894 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -62.58 -42.46 99.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.776 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -65.75 -32.29 73.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.081 178.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.02 -46.18 94.03 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 201' ' ' LEU . 28.9 mt -63.42 -42.02 98.72 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.028 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.59 -36.58 84.27 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -42.02 98.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.379 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.489 HD21 ' OE1' ' A' ' 141' ' ' GLU . 78.7 mt -61.62 -41.55 97.63 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -64.25 -42.48 96.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.024 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.696 ' O ' ' N ' ' A' ' 210' ' ' GLN . 15.4 mmm180 -65.32 -40.9 94.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.981 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.66 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.2 t -63.77 -45.38 97.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.043 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.9 p -67.85 -28.19 67.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.762 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -101.66 -14.67 17.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.61 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.696 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.6 tt0 -131.59 -28.2 1.86 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.86 0.362 . . . . 0.0 111.107 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.66 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -79.14 25.74 2.62 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.506 ' CE1' ' O ' ' A' ' 127' ' ' SER . 30.7 t80 -60.41 -44.8 95.37 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.747 0.308 . . . . 0.0 110.2 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.483 ' O ' ' OG ' ' A' ' 213' ' ' SER . 0.0 OUTLIER -172.8 18.04 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.03 -179.813 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 30.9 p -132.54 161.54 33.54 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.743 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -154.62 146.77 23.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.233 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -115.92 172.58 7.06 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.755 0.312 . . . . 0.0 110.946 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -162.44 35.53 0.11 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.652 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.538 ' O ' ' CB ' ' A' ' 219' ' ' GLU . 99.5 m-85 -107.63 140.26 40.91 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.919 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.538 ' CB ' ' O ' ' A' ' 218' ' ' PHE . 8.4 tm-20 92.43 -32.27 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 179.101 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -60.74 155.59 50.65 Favored Pre-proline 0 N--CA 1.464 0.235 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.203 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 31.7 Cg_exo -57.12 119.32 6.51 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 C-N-CA 122.149 1.9 . . . . 0.0 112.051 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 63.2 ttm-85 178.63 -93.58 0.0 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.757 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.559 HG11 HD22 ' A' ' 308' ' ' LEU . 0.2 OUTLIER -60.55 -47.16 93.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.733 -179.388 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.429 HD11 ' HE1' ' A' ' 250' ' ' PHE . 1.1 mp -65.41 -26.71 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.836 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -67.45 -46.54 72.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 109.767 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.566 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 5.0 tp -61.14 -41.27 96.43 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.354 179.302 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.469 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 44.2 m0 -60.06 -42.01 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.066 -0.653 . . . . 0.0 109.677 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -65.06 -29.84 70.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 4.0 mt -62.2 -43.26 99.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.872 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.932 ' O ' HD21 ' A' ' 235' ' ' LEU . . . -36.07 -42.91 0.31 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.919 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -39.53 -34.24 0.21 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.855 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 39.3 m -130.87 66.14 1.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.532 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 233' ' ' ALA . . . . . 0.936 ' H ' HD11 ' A' ' 235' ' ' LEU . . . -144.2 46.7 1.42 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 58.9 t30 63.17 73.56 0.45 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.494 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.936 HD11 ' H ' ' A' ' 233' ' ' ALA . 0.3 OUTLIER -108.85 -160.32 0.72 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.095 0.474 . . . . 0.0 110.843 179.719 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.4 ' OG1' ' CD ' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -131.74 -146.97 0.3 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.746 -179.157 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -101.59 -66.17 0.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.814 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.35 -40.9 97.92 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.446 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 239' ' ' GLU . . . . . 0.502 ' HA ' ' HB3' ' A' ' 322' ' ' GLU . 34.0 mt-10 -61.93 -35.38 78.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.884 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.683 ' O ' HD13 ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.15 -46.04 89.05 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.79 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -65.34 -44.81 86.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.473 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 242' ' ' ALA . . . . . 0.623 ' HB1' ' CZ ' ' A' ' 319' ' ' ARG . . . -60.27 -41.45 93.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 243' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.49 -44.67 93.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.724 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -58.76 -52.98 63.39 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 -178.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -64.96 -36.91 85.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.697 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -61.79 -45.0 95.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.359 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.488 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 1.9 mm? -63.34 -41.23 98.86 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.768 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.74 -39.81 90.08 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.888 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -63.96 -63.04 1.26 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 250' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 250' ' ' PHE . 29.4 t80 -59.78 -45.23 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 0.0 110.924 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.488 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 53.1 tp10 -55.03 -41.58 71.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.15 80.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -59.92 -45.83 91.34 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.838 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 254' ' ' ILE . . . . . 0.468 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.4 tp -66.84 -42.42 89.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.919 179.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.34 -45.59 92.91 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.713 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.73 -41.58 99.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.29 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -43.45 81.04 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -61.58 -40.79 96.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.212 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 259' ' ' HIS . . . . . 0.513 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 79.7 t60 -58.96 -47.95 83.29 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.212 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -62.29 -37.04 83.97 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.344 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -58.61 -43.79 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -61.82 -46.92 87.38 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.805 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 263' ' ' GLN . . . . . 0.513 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.0 mp0 -63.39 -36.77 84.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.864 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 50.3 tp -61.66 -42.46 98.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.348 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -63.05 -46.8 85.8 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.74 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.6 mt -63.02 -42.98 98.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.965 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.81 83.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.084 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -62.18 -44.88 95.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.35 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -59.24 -46.84 87.42 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.048 0.451 . . . . 0.0 110.344 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -60.48 -40.38 91.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.345 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.4 ' CD2' ' OE2' ' A' ' 275' ' ' GLU . 5.4 tt -59.52 -44.11 93.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -59.37 -44.48 92.73 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.995 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -67.63 -42.62 82.04 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.668 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 274' ' ' ALA . . . . . 0.637 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -60.7 -35.35 76.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.926 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 275' ' ' GLU . . . . . 0.4 ' OE2' ' CD2' ' A' ' 271' ' ' LEU . 90.7 mt-10 -61.31 -28.83 69.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.843 0.354 . . . . 0.0 110.447 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 97.1 p -89.1 5.91 42.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 277' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 274' ' ' ALA . 11.8 p -60.88 -44.2 97.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.702 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.56 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 134.76 -86.67 0.25 Allowed Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -62.93 -39.96 96.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.721 0.296 . . . . 0.0 110.603 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 280' ' ' GLY . . . . . 0.578 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 87.91 -106.52 3.22 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 63.16 -53.8 0.19 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.851 0.358 . . . . 0.0 110.568 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 282' ' ' ARG . . . . . 0.578 ' N ' ' O ' ' A' ' 280' ' ' GLY . 16.4 ptm180 -72.26 -15.42 61.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.509 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.8 t -60.61 -44.95 97.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.43 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.1 t -59.97 -44.9 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.006 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -61.59 -43.21 99.29 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.025 0.44 . . . . 0.0 110.532 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 5.6 t -60.94 -42.35 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.093 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -61.67 -41.72 97.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.279 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -57.62 -53.74 54.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.262 -0.427 . . . . 0.0 109.895 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.445 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.1 mmtm -64.62 -34.36 78.09 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.211 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -58.21 -46.41 85.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.058 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.78 -40.36 79.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.913 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.699 ' O ' HD12 ' A' ' 292' ' ' LEU . 1.3 tp -62.92 -52.86 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.87 -43.28 99.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.149 0.5 . . . . 0.0 110.232 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.01 -36.54 84.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.88 -50.44 65.76 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 110.539 -1.025 . . . . 0.0 110.539 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -59.69 -41.28 90.36 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 5.9 m -59.45 -49.15 78.92 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 120.962 0.41 . . . . 0.0 110.04 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -63.72 -44.29 94.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -57.74 -40.22 79.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.03 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.24 -43.14 99.49 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.855 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.95 -43.4 94.93 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -61.88 -44.45 96.79 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.095 0.474 . . . . 0.0 110.778 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.5 m -60.07 -43.7 95.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.206 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.4 -44.24 92.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.924 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.78 -54.66 43.81 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.076 -179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -62.98 -41.69 99.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.46 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.696 ' NE2' HD13 ' A' ' 311' ' ' LEU . 5.3 t-160 -61.68 -39.15 90.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.047 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.559 HD22 HG11 ' A' ' 223' ' ' VAL . 26.0 mt -60.66 -44.55 96.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.439 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 309' ' ' GLN . . . . . 0.598 ' N ' ' OE1' ' A' ' 309' ' ' GLN . 0.0 OUTLIER -63.12 -49.31 74.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.592 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -63.03 -68.88 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.158 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.696 HD13 ' NE2' ' A' ' 307' ' ' HIS . 1.8 tp -41.68 -46.4 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.704 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 56.6 m -60.02 -41.8 92.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.514 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.59 -35.96 92.57 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.562 ' O ' HD11 ' A' ' 323' ' ' LEU . 18.1 mmm180 -73.54 -64.69 0.94 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.829 0.314 . . . . 0.0 110.977 -179.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.721 HG22 ' N ' ' A' ' 316' ' ' SER . 0.8 OUTLIER -40.59 -104.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.228 -179.071 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 316' ' ' SER . . . . . 0.721 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.0 OUTLIER 62.37 -5.27 0.18 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.608 ' HD2' HD12 ' A' ' 323' ' ' LEU . 0.1 OUTLIER -173.04 -33.71 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.534 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.541 ' N ' ' HD3' ' A' ' 317' ' ' ARG . . . -165.79 -97.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.908 ' O ' HD22 ' A' ' 323' ' ' LEU . 7.7 ptm180 -175.03 156.29 2.13 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 320' ' ' HIS . . . . . 0.817 ' O ' ' N ' ' A' ' 322' ' ' GLU . 86.4 t60 -25.81 136.98 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 113.863 -1.517 . . . . 0.0 112.955 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.618 ' C ' ' H ' ' A' ' 323' ' ' LEU . 64.6 m-20 54.79 -58.99 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.61 0.719 . . . . 0.0 109.099 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.817 ' N ' ' O ' ' A' ' 320' ' ' HIS . 80.2 mm-40 -65.06 36.56 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.283 -1.326 . . . . 0.0 109.909 178.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.908 HD22 ' O ' ' A' ' 319' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.609 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 t -135.16 141.6 45.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.558 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 74.5 ttt-85 -159.05 99.11 1.5 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.667 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -141.12 142.7 34.06 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.843 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -135.04 133.09 39.01 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.637 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -151.1 146.01 25.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.717 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -82.83 138.93 43.2 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.552 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -73.04 154.76 52.76 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.828 2.352 . . . . 0.0 112.4 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.97 160.03 53.21 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.309 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -63.96 147.14 91.98 Favored 'Trans proline' 0 C--N 1.302 -1.883 0 C-N-CA 122.882 2.388 . . . . 0.0 112.327 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.463 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -171.77 -58.91 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.545 -179.766 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 11' ' ' SER . 29.6 Cg_endo -63.59 -171.18 0.13 Allowed 'Trans proline' 0 N--CA 1.497 1.681 0 C-N-CA 122.447 2.098 . . . . 0.0 112.231 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.535 ' HG2' ' H ' ' A' ' 15' ' ' GLU . 39.6 ttmt -41.86 113.71 0.46 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.519 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -91.9 14.57 15.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.908 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.535 ' H ' ' HG2' ' A' ' 13' ' ' LYS . 81.4 tt0 63.8 150.49 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.3 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.8 -142.47 0.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.242 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.79 21.73 6.63 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -51.1 133.85 27.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.855 0.36 . . . . 0.0 110.577 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -65.74 -37.21 85.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.67 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -108.19 177.83 4.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.922 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -64.48 -36.8 85.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.82 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.6 mmm -118.56 148.75 42.33 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.21 0.529 . . . . 0.0 110.788 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.67 -38.12 88.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.694 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.29 -47.59 83.16 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.185 0.517 . . . . 0.0 110.321 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.9 tp -63.14 -38.59 91.78 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.501 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -64.24 -40.02 95.15 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.379 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.7 tp60 -62.81 -42.21 99.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.163 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -62.08 -44.4 96.74 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.016 0.436 . . . . 0.0 109.95 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -60.51 -49.57 77.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.362 0.601 . . . . 0.0 110.385 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -58.22 -38.54 77.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.279 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 tppt? -60.61 -46.06 91.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.179 0.514 . . . . 0.0 110.235 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.46 91.91 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.006 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -58.58 -38.64 78.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.194 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.571 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 62.8 ttm-85 -62.47 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.45 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.512 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.571 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 63.7 m-70 66.0 113.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.7 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 mt -137.45 154.99 75.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.858 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -43.31 155.1 0.16 Allowed 'Trans proline' 0 C--N 1.311 -1.434 0 C-N-CA 122.657 2.238 . . . . 0.0 112.12 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -65.43 -34.78 42.21 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.648 2.232 . . . . 0.0 112.094 -179.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.41 HG22 ' H ' ' A' ' 40' ' ' VAL . 3.0 m -68.02 -47.94 76.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.673 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.408 ' H ' HG23 ' A' ' 40' ' ' VAL . 96.9 mtt180 -66.87 -40.06 87.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.416 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.28 -44.09 97.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.501 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.58 -45.53 90.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.431 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.7 tp10 -66.72 -42.76 85.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.502 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.88 -49.55 74.38 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.728 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -58.94 -40.54 84.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.053 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.66 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.36 -48.82 80.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.682 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.11 -49.31 72.06 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.539 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.6 mt -58.59 -40.62 83.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.145 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.27 -37.37 80.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.981 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.9 mm -63.23 -43.44 98.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.792 179.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -57.14 -45.76 83.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.165 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.94 -49.9 76.08 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.263 0.554 . . . . 0.0 110.133 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -59.53 -44.77 93.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.457 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -61.41 -37.54 83.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -58.45 -47.93 82.38 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.007 0.432 . . . . 0.0 109.864 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 57' ' ' LEU . 32.0 mt -60.75 -42.01 96.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.211 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.25 -48.2 82.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.428 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -56.8 -39.28 73.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.253 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm -59.86 -46.64 88.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -60.6 -45.51 93.71 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.471 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.15 -39.55 92.99 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.99 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -58.66 -42.97 89.66 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.735 HD13 ' O ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -60.58 -42.64 97.09 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.68 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -69.5 -21.47 63.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.202 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 85.23 14.58 68.61 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.1 -43.5 95.17 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.959 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -78.33 141.13 38.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.541 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -148.58 -46.93 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.627 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -65.76 -32.22 73.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.641 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.23 13.09 69.21 Favored Glycine 0 CA--C 1.527 0.832 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.56 -38.94 86.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.755 0.312 . . . . 0.0 110.332 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.599 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 55.4 mttp -56.78 -57.57 11.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.004 0.43 . . . . 0.0 110.154 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -53.2 -39.14 63.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.183 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.85 -40.25 92.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.272 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.599 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 88.0 mtm180 -63.35 -39.26 94.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.58 -44.5 93.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -47.24 89.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.381 0.61 . . . . 0.0 110.224 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.615 ' O ' HG23 ' A' ' 83' ' ' VAL . 2.9 ttt180 -61.44 -41.93 97.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.119 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.49 ' O ' HG13 ' A' ' 84' ' ' ILE . 8.2 t-20 -61.25 -41.03 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.257 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.688 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.75 -48.69 80.68 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.191 0.52 . . . . 0.0 110.06 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.75 -39.13 87.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.578 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.2 t -63.52 -45.98 96.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.411 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -60.43 -49.01 86.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.354 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.73 -42.82 85.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.965 0.412 . . . . 0.0 111.069 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.62 -45.82 92.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.549 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.66 -47.46 83.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.602 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.83 -22.35 66.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.128 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 77.15 19.81 76.48 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 90' ' ' LEU . 43.8 mt -89.09 -1.07 57.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.816 0.341 . . . . 0.0 110.422 179.774 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -82.44 57.11 3.53 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.047 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -83.66 -161.5 31.94 Favored Glycine 0 CA--C 1.523 0.556 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.096 -178.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 94' ' ' LYS . 98.8 mttt 62.79 -177.8 0.14 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.371 -0.415 . . . . 0.0 110.37 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 93' ' ' LYS . 48.5 tptt 54.87 114.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.227 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.651 ' C ' ' H ' ' A' ' 97' ' ' ARG . 94.7 m-20 50.08 -165.67 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.876 179.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 95' ' ' ASP . . . 65.59 -21.35 0.09 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.311 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.651 ' H ' ' C ' ' A' ' 95' ' ' ASP . 60.0 ttt85 -65.55 -42.63 91.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.885 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.46 ' O ' ' O ' ' A' ' 97' ' ' ARG . 86.7 mt-30 46.77 99.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.131 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 63.4 t -61.91 -45.16 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.277 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 57.7 p -133.49 158.57 42.77 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.483 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.6 m -176.59 -48.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.726 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.484 ' O ' ' OD1' ' A' ' 102' ' ' ASN . 40.3 p30 -75.32 140.97 43.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.588 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.5 m -134.93 57.48 1.81 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.632 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.624 ' C ' ' H ' ' A' ' 106' ' ' GLY . 88.8 mt -97.92 15.59 23.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.797 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.39 -19.94 0.09 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.614 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.624 ' H ' ' C ' ' A' ' 104' ' ' LEU . . . 47.7 94.29 0.01 OUTLIER Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.7 m -121.73 126.13 48.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.756 0.312 . . . . 0.0 110.611 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.444 ' O ' ' O ' ' A' ' 109' ' ' GLU . 72.5 tp60 -150.43 149.97 30.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.319 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.444 ' O ' ' O ' ' A' ' 108' ' ' GLN . 83.6 tt0 59.52 135.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.488 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 109' ' ' GLU . 97.5 m-20 -140.37 124.34 17.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.548 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -101.6 -70.65 0.89 Allowed Glycine 0 CA--C 1.522 0.516 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.508 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -139.58 -171.05 3.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.774 0.321 . . . . 0.0 110.71 -179.853 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.602 ' CG ' ' H ' ' A' ' 114' ' ' ASP . 21.6 p30 -98.25 -78.49 0.49 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.918 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.602 ' H ' ' CG ' ' A' ' 113' ' ' ASP . 21.5 m-20 -48.97 114.08 3.52 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.49 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.77 -35.02 56.97 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.539 2.159 . . . . 0.0 112.219 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -58.52 -45.27 89.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.687 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.2 mt -69.14 -36.07 77.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.005 0.431 . . . . 0.0 110.727 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.508 ' OE2' ' O ' ' A' ' 112' ' ' LEU . 93.8 mt-10 -61.05 -34.65 75.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.619 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 71.3 mmtt -59.91 -44.07 94.48 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.468 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.12 -44.44 72.39 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.885 0.374 . . . . 0.0 111.69 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.6 ' CZ3' HD22 ' A' ' 135' ' ' LEU . 16.4 t-105 -61.57 -46.69 88.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.847 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -68.57 -37.61 80.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.768 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.7 OUTLIER -57.31 -51.92 67.42 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.898 -178.543 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.438 ' HB1' ' HB2' ' A' ' 130' ' ' PHE . . . -73.32 -45.99 52.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.999 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.501 ' HB2' HD11 ' A' ' 135' ' ' LEU . 62.1 tttm -48.54 -44.19 36.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.84 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.8 m -108.62 -63.46 1.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.907 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -54.89 -11.73 0.68 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.598 -178.725 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.56 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -131.76 -3.09 4.19 Favored Glycine 0 CA--C 1.519 0.301 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' SER . 46.5 mttp 54.69 8.71 0.23 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.223 0.535 . . . . 0.0 109.848 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PHE . . . . . 0.56 ' CD1' ' O ' ' A' ' 128' ' ' GLY . 14.2 m-30 -67.82 51.19 0.06 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.821 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.553 ' HA ' HD12 ' A' ' 135' ' ' LEU . 96.8 p -97.63 112.29 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.762 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.403 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.94 -97.93 0.59 Allowed Glycine 0 CA--C 1.528 0.871 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.299 178.241 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.7 mm-40 -77.74 -44.01 29.11 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.042 -179.135 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.4 mp0 -65.6 -43.87 88.35 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.529 -0.469 . . . . 0.0 109.9 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.6 HD22 ' CZ3' ' A' ' 121' ' ' TRP . 0.6 OUTLIER -62.04 -41.4 98.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.886 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -63.67 -36.93 85.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.945 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.2 mttt -63.0 -44.1 96.95 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.418 0.628 . . . . 0.0 110.057 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.02 -42.55 94.59 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -66.07 -37.83 86.79 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.619 -0.718 . . . . 0.0 112.687 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.547 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 0.6 OUTLIER -51.85 -41.64 62.0 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.766 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 141' ' ' GLU . 0.7 OUTLIER -70.22 -42.42 72.32 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.539 178.672 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.41 -52.85 63.86 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.209 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.539 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.5 mm? -61.96 -40.64 96.26 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.307 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.547 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 45.2 m170 -53.55 -44.99 69.69 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.474 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.497 ' CD2' HG23 ' A' ' 197' ' ' ILE . 5.5 m80 -63.83 -41.63 97.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.572 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.6 mmmt -60.27 -41.47 93.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.159 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' GLU . . . . . 0.472 ' HA ' ' ND1' ' A' ' 150' ' ' HIS . 50.5 mt-10 -70.2 -55.49 9.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.558 -179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -63.52 -44.21 94.93 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.406 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.523 ' CG1' ' N ' ' A' ' 150' ' ' HIS . 2.8 p -60.83 -44.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.438 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.696 ' CD2' ' C ' ' A' ' 150' ' ' HIS . 1.2 p-80 -66.15 -33.71 76.4 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.324 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.609 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 91.7 mt-10 -63.33 -39.94 95.94 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.313 -0.555 . . . . 0.0 109.892 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -61.93 -49.4 76.32 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.084 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -68.64 -43.78 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 19.3 t -60.75 -45.07 98.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.096 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.4 mt -63.21 -45.71 90.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.539 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.409 ' O ' ' OG ' ' A' ' 160' ' ' SER . 19.9 mt -65.29 -42.51 93.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.752 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -68.8 -31.09 69.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.193 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 66.1 m -68.98 -48.06 64.07 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.97 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 160' ' ' SER . 4.3 pp -78.97 -36.96 40.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.821 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.808 ' N ' HD12 ' A' ' 159' ' ' LEU . 67.3 m -59.47 -45.59 91.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.867 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 70.3 mtp180 -73.37 -46.73 47.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.206 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' THR . . . . . 0.619 HG22 ' N ' ' A' ' 163' ' ' GLU . 87.5 m -80.38 164.95 22.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.781 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.619 ' N ' HG22 ' A' ' 162' ' ' THR . 78.6 tt0 65.05 -1.24 0.9 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.14 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' GLU . . . . . 0.478 ' H ' ' C ' ' A' ' 162' ' ' THR . 88.4 mt-10 -149.01 23.31 0.96 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.46 179.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 165' ' ' ILE . . . . . 0.555 ' O ' HG23 ' A' ' 165' ' ' ILE . 9.9 tp -57.0 123.25 7.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.365 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 165' ' ' ILE . 44.0 m80 -155.41 25.58 0.41 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.355 0.597 . . . . 0.0 109.601 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.431 ' O ' ' O ' ' A' ' 168' ' ' ASN . 81.4 tt0 53.14 73.75 0.34 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.946 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.431 ' O ' ' O ' ' A' ' 167' ' ' GLU . 97.3 m-20 59.52 126.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.843 179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 56.8 t -130.2 133.73 63.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.472 HG23 ' O ' ' A' ' 170' ' ' ILE . 20.7 tt -131.36 128.47 61.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.596 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 18.3 m -160.31 85.86 1.96 Allowed Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 120.75 0.31 . . . . 0.0 110.177 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -41.08 95.51 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.684 2.256 . . . . 0.0 111.971 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 14.8 t -140.11 140.76 36.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.656 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -59.5 -46.8 87.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.308 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' A' ' 177' ' ' ASP . 84.0 mt -134.3 107.06 7.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.169 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 1.3 m 44.93 -85.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.188 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' ASP . . . . . 0.611 ' N ' ' O ' ' A' ' 175' ' ' LEU . 66.4 t0 -173.95 44.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.681 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.638 ' O ' ' N ' ' A' ' 180' ' ' GLY . 1.1 pp -139.21 39.74 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.582 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 63.8 mttm 59.28 -65.8 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.578 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.638 ' N ' ' O ' ' A' ' 178' ' ' ILE . . . 157.5 53.91 0.01 OUTLIER Glycine 0 CA--C 1.524 0.601 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 83.1 p -121.7 -4.26 9.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.752 0.311 . . . . 0.0 110.735 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.808 HG12 ' H ' ' A' ' 183' ' ' LEU . 11.9 t -142.31 178.14 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.614 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.808 ' H ' HG12 ' A' ' 182' ' ' VAL . 82.3 mt 60.08 3.82 0.56 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.872 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.465 ' ND1' ' N ' ' A' ' 185' ' ' SER . 1.9 p80 -58.54 -43.27 89.22 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.667 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.465 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 36.2 t -62.36 -44.97 95.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.276 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.509 HH22 HD22 ' A' ' 159' ' ' LEU . 43.0 ttt85 -60.99 -45.06 96.3 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.994 0.426 . . . . 0.0 110.937 -179.119 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 187' ' ' HIS . . . . . 0.455 ' ND1' HD22 ' A' ' 175' ' ' LEU . 34.9 m170 -63.99 -35.04 79.4 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.022 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 51.7 m -61.35 -42.65 99.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.734 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.97 -38.14 89.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.591 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 187' ' ' HIS . 0.8 OUTLIER -60.98 -45.25 95.55 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.718 179.367 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 63.3 mttp -70.15 -36.1 74.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 192' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 2.9 tm-20 -68.06 -47.9 67.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.059 0.457 . . . . 0.0 111.741 -178.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.469 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 15.8 pttt -73.13 -41.61 63.78 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.416 -179.219 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.757 ' C ' HD12 ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.67 -41.11 79.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.063 -179.59 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 195' ' ' ARG . . . . . 0.535 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 36.1 ptt180 -67.57 -39.12 84.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 67.4 m -58.64 -42.38 88.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 197' ' ' ILE . . . . . 0.497 HG23 ' CD2' ' A' ' 145' ' ' HIS . 91.2 mt -64.14 -43.64 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.429 178.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -61.1 -40.92 95.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.415 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 199' ' ' GLN . . . . . 0.504 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 94.7 mt-30 -60.51 -40.31 90.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.52 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.6 -41.48 99.58 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 197' ' ' ILE . 1.4 mm? -63.24 -41.17 99.04 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.155 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 202' ' ' ASP . . . . . 0.551 ' OD1' ' C ' ' A' ' 202' ' ' ASP . 0.2 OUTLIER -62.61 -37.39 86.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.41 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 203' ' ' ARG . . . . . 0.459 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 8.0 tmm_? -61.46 -43.85 98.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.731 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.1 mt -61.67 -40.26 94.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -64.85 -42.04 95.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.126 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.744 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -61.43 -45.33 94.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.366 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 207' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.296 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.564 ' O ' ' CG ' ' A' ' 212' ' ' TYR . 89.3 p -61.89 -37.33 84.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.543 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -94.33 -43.09 8.57 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.102 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 210' ' ' GLN . . . . . 0.744 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.6 tt0 -87.05 -42.92 12.7 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 211' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -71.98 14.28 2.21 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 212' ' ' TYR . . . . . 0.564 ' CG ' ' O ' ' A' ' 208' ' ' SER . 2.5 m-85 -103.77 146.72 28.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.126 0.489 . . . . 0.0 111.31 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 36.5 t -62.0 143.98 55.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.83 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 48.9 p -111.32 -164.6 0.93 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.702 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 63.2 157.95 0.07 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.598 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -92.6 169.38 10.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.286 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.5 ' N ' ' OE1' ' A' ' 217' ' ' GLU . 57.0 mp0 -139.45 34.57 2.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 218' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' A' ' 219' ' ' GLU . 45.7 p90 -62.48 -48.54 79.13 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 120.755 0.312 . . . . 0.0 110.406 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 220' ' ' GLU . 11.3 tm-20 -110.86 -78.72 0.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.115 0.483 . . . . 0.0 110.292 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 220' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 0.0 OUTLIER 54.78 169.91 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.988 -179.878 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.557 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 41.4 Cg_exo -55.85 150.86 43.57 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.461 2.107 . . . . 0.0 112.025 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 222' ' ' ARG . . . . . 0.715 ' O ' ' N ' ' A' ' 225' ' ' ASP . 24.1 ttp180 87.51 -139.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.493 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 223' ' ' VAL . . . . . 0.527 HG23 ' H ' ' A' ' 224' ' ' ILE . 2.5 m 27.77 -104.17 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.207 0.527 . . . . 0.0 110.72 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.527 ' H ' HG23 ' A' ' 223' ' ' VAL . 1.3 mp -59.78 -39.05 78.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.787 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 225' ' ' ASP . . . . . 0.715 ' N ' ' O ' ' A' ' 222' ' ' ARG . 55.9 m-20 -62.53 -40.66 97.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.8 tp -60.0 -43.56 95.11 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.338 0.59 . . . . 0.0 109.491 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 227' ' ' TRP . . . . . 0.433 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 26.0 m0 -63.14 -33.95 76.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.695 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -61.42 -38.95 88.98 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 229' ' ' LEU . . . . . 0.513 ' O ' ' N ' ' A' ' 232' ' ' SER . 97.8 mt -63.44 -42.1 98.66 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.787 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 230' ' ' ALA . . . . . 0.498 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -28.3 -44.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.955 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 231' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 229' ' ' LEU . 62.9 tt0 -67.33 -53.56 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.719 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 229' ' ' LEU . 30.2 t -68.61 -18.1 64.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.5 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -69.02 -82.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.657 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -177.6 98.81 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.631 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 235' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 235' ' ' LEU . 53.4 mt -145.09 151.62 38.79 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.1 p -79.62 169.25 18.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.691 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -61.38 -48.24 82.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.829 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -60.28 -49.29 78.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.99 0.424 . . . . 0.0 110.817 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.24 -37.52 85.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.675 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.78 -40.57 95.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.43 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.95 -55.6 31.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.612 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -59.39 -37.13 77.19 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.776 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 243' ' ' PHE . . . . . 0.583 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.4 OUTLIER -63.33 -45.92 89.02 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.938 178.827 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 244' ' ' ARG . . . . . 0.445 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 45.0 ttm180 -60.91 -45.02 96.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.071 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -65.93 -46.56 77.78 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 51.8 tp10 -59.67 -47.42 85.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.583 HD23 ' O ' ' A' ' 243' ' ' PHE . 2.4 mm? -63.73 -39.39 94.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.798 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 86.5 tttt -54.81 -48.1 73.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.165 0.507 . . . . 0.0 110.115 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -67.74 -37.96 82.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -61.05 -49.56 76.88 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.833 0.349 . . . . 0.0 111.066 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 251' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 16.1 pt-20 -62.41 -35.4 79.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.894 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.11 92.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.386 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.29 -50.78 68.76 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.978 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -30.36 49.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.176 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -64.54 -46.39 83.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 110.172 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -62.89 -44.45 96.06 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.349 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -57.61 -42.99 84.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.253 179.469 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -61.15 -40.79 95.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.133 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 259' ' ' HIS . . . . . 0.533 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 81.9 t60 -59.43 -47.08 86.86 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.27 0.557 . . . . 0.0 110.279 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -62.44 -36.23 81.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.371 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 21.1 mm100 -61.71 -42.37 98.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.214 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -60.62 -47.66 85.21 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 263' ' ' GLN . . . . . 0.533 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 3.7 mp0 -65.78 -37.67 86.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.166 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.73 -43.5 98.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.248 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -62.81 -48.93 76.99 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.13 0.49 . . . . 0.0 110.424 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 70.3 mt -62.3 -43.0 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.901 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.54 76.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -63.88 -49.29 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.279 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.75 -44.03 82.53 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.037 0.446 . . . . 0.0 110.672 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -62.39 -45.75 91.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.572 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.54 HD13 ' CB ' ' A' ' 286' ' ' SER . 42.8 tp -62.05 -42.46 99.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.785 0.326 . . . . 0.0 110.344 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -57.25 -42.8 82.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.277 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -80.14 -26.92 39.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.528 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.55 -38.14 90.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.735 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -53.73 -20.91 6.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.548 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 73.5 m -62.37 -37.18 84.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.73 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.0 t -61.01 -45.22 98.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.49 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 98.74 17.78 27.24 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 279' ' ' ASP . . . . . 0.424 ' O ' HG23 ' A' ' 283' ' ' VAL . 99.8 m-20 -82.5 106.63 14.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.823 0.344 . . . . 0.0 110.462 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.21 91.8 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -61.63 -53.93 49.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.769 0.319 . . . . 0.0 110.632 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -68.2 -43.88 77.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.778 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 283' ' ' VAL . . . . . 0.577 ' CG1' ' NH1' ' A' ' 287' ' ' ARG . 41.8 t -61.85 -48.28 89.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.701 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 42.9 t -62.99 -46.04 89.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.777 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -63.25 -41.33 99.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.788 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 286' ' ' SER . . . . . 0.54 ' CB ' HD13 ' A' ' 271' ' ' LEU . 55.4 m -59.64 -45.3 92.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.398 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 287' ' ' ARG . . . . . 0.577 ' NH1' ' CG1' ' A' ' 283' ' ' VAL . 59.6 mtt85 -64.03 -38.16 90.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.975 0.417 . . . . 0.0 110.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -57.76 -60.98 2.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.393 0.616 . . . . 0.0 110.238 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 289' ' ' LYS . . . . . 0.513 ' HD3' HD23 ' A' ' 292' ' ' LEU . 4.9 mmtp -63.34 -40.46 97.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.043 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -42.62 -52.49 4.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.182 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.09 -37.63 78.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.677 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 292' ' ' LEU . . . . . 0.513 HD23 ' HD3' ' A' ' 289' ' ' LYS . 22.8 tp -61.41 -52.28 65.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.587 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.83 -42.05 97.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.251 0.548 . . . . 0.0 109.991 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 294' ' ' GLU . . . . . 0.502 ' O ' ' OG1' ' A' ' 297' ' ' THR . 82.3 tt0 -62.25 -35.34 78.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.695 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.47 -44.81 94.69 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -59.58 -43.48 93.63 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.09 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 297' ' ' THR . . . . . 0.502 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 36.0 p -60.5 -42.19 95.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.243 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -63.73 -45.12 91.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.434 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -60.92 -44.15 97.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.305 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -42.74 99.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.962 0.411 . . . . 0.0 110.429 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.28 -43.23 95.66 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -62.15 -42.86 99.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.399 . . . . 0.0 110.449 178.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 10.5 m -61.25 -44.96 96.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.482 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.56 -43.27 90.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.972 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -59.33 -49.6 77.2 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.626 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -62.9 -43.56 98.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.341 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 307' ' ' HIS . . . . . 0.538 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.58 -37.05 85.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.138 179.321 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 308' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 312' ' ' SER . 11.8 mt -61.34 -41.87 97.75 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.436 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -68.52 -58.84 3.71 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.05 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.11 -48.79 78.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.265 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 311' ' ' LEU . . . . . 0.561 HD12 ' NH2' ' A' ' 314' ' ' ARG . 12.4 tp -61.0 -42.78 99.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.703 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 312' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 67.2 p -61.67 -36.11 79.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.519 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.26 -44.96 89.69 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 314' ' ' ARG . . . . . 0.561 ' NH2' HD12 ' A' ' 311' ' ' LEU . 87.0 mtm180 -63.2 -43.46 98.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.738 0.304 . . . . 0.0 110.855 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.442 ' O ' HG22 ' A' ' 315' ' ' ILE . 2.1 mm -74.09 -15.79 16.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.692 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 6.1 t -53.49 -48.65 68.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.262 0.553 . . . . 0.0 109.726 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.688 ' C ' ' H ' ' A' ' 319' ' ' ARG . 19.9 ptp180 -109.2 -26.2 10.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.76 -176.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 317' ' ' ARG . . . 70.03 -30.53 0.2 Allowed 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 119.116 -1.033 . . . . 0.0 109.407 -178.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 319' ' ' ARG . . . . . 0.688 ' H ' ' C ' ' A' ' 317' ' ' ARG . 6.3 tpt180 66.18 161.69 0.15 Allowed 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -177.036 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -65.22 -40.86 94.66 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.101 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 321' ' ' ASN . . . . . 0.597 ' O ' ' N ' ' A' ' 323' ' ' LEU . 64.1 t30 -117.83 158.93 23.92 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 122.205 -0.309 . . . . 0.0 110.569 177.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 322' ' ' GLU . . . . . 0.464 ' O ' ' C ' ' A' ' 323' ' ' LEU . 81.3 tt0 -35.16 88.68 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 O-C-N 122.014 -0.429 . . . . 0.0 110.868 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 323' ' ' LEU . . . . . 0.831 HD22 ' H ' ' A' ' 323' ' ' LEU . 3.6 mm? . . . . . 0 C--N 1.317 -0.821 0 CA-C-O 118.072 -0.966 . . . . 0.0 111.412 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.719 0.295 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.485 ' C ' ' SD ' ' A' ' 22' ' ' MET . 73.2 ttp85 -67.77 -18.68 64.95 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.525 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.486 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -115.32 137.14 52.35 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.206 0.526 . . . . 0.0 111.102 -179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.94 -36.49 84.55 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.474 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.602 ' HA ' HE21 ' A' ' 27' ' ' GLN . 63.9 tttp -60.72 -47.35 86.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.106 0.479 . . . . 0.0 110.26 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.7 mp -61.77 -38.25 87.35 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.486 ' ND2' ' O ' ' A' ' 22' ' ' MET . 57.7 m-80 -62.32 -40.69 97.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.972 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.602 HE21 ' HA ' ' A' ' 24' ' ' LYS . 34.3 mt-30 -60.84 -45.7 93.48 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.722 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.22 -41.03 96.15 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.032 0.444 . . . . 0.0 109.973 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -57.96 -44.71 87.2 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.121 0.486 . . . . 0.0 109.787 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -60.48 -37.46 81.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.616 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 73.5 mmtt -61.38 -42.53 98.87 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.255 0.55 . . . . 0.0 109.678 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.72 -37.31 86.05 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.149 -0.621 . . . . 0.0 110.113 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -61.15 -46.37 90.82 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.254 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.616 ' HG2' ' O ' ' A' ' 31' ' ' LYS . 53.6 ptt85 -66.19 -35.1 79.57 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.119 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.36 -38.63 91.91 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.051 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.77 110.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.707 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 mt -132.69 154.59 81.54 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.741 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 79.0 Cg_exo -42.54 154.3 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.415 2.077 . . . . 0.0 112.487 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.1 Cg_exo -58.12 -46.86 22.87 Favored 'Trans proline' 0 N--CA 1.497 1.73 0 C-N-CA 122.615 2.21 . . . . 0.0 112.51 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.472 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 62.2 t -64.14 -46.46 93.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.726 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -64.06 -41.86 97.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.133 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.97 -44.2 97.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.61 90.47 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.71 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.472 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 1.7 mp0 -67.73 -46.94 70.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.84 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.533 HD13 ' OH ' ' A' ' 88' ' ' TYR . 55.6 tp -63.16 -46.92 84.91 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.023 0.44 . . . . 0.0 110.489 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -59.27 -42.32 90.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.05 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.578 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.62 -47.64 84.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.939 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -56.01 -47.13 78.34 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.68 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.32 -40.86 87.61 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -59.4 -39.34 83.1 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.842 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 47' ' ' ALA . 40.6 mm -62.33 -43.7 98.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -55.5 -44.71 76.84 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.267 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -60.08 -46.53 89.28 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.088 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -60.66 -44.48 96.38 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.364 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -61.07 -37.45 82.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.311 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -60.44 -45.1 94.89 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.26 -42.01 97.9 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.213 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.54 94.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.014 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -58.6 -43.53 89.59 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.759 0.314 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -60.2 -46.57 89.26 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.012 0.434 . . . . 0.0 110.044 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.79 -39.57 94.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.786 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.6 mt -61.57 -43.17 99.36 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.27 -37.02 85.99 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.907 179.879 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.567 0 N-CA-C 110.681 -0.967 . . . . 0.0 110.681 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -64.05 -34.75 78.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.37 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.1 -50.1 75.35 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.088 0.47 . . . . 0.0 109.857 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -61.4 -41.89 97.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.188 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.23 89.85 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.382 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -62.5 -42.74 99.71 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.642 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.16 -43.45 98.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.522 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.9 -44.53 98.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 121.094 0.473 . . . . 0.0 109.966 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.758 ' O ' HG23 ' A' ' 83' ' ' VAL . 20.7 mmm180 -59.87 -41.12 90.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.098 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.78 -39.34 94.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.39 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.582 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.43 -49.14 78.95 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.39 -179.58 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -64.31 -39.02 93.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.512 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 79' ' ' ARG . 70.7 t -62.18 -46.21 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.835 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.7 mt -61.53 -47.66 92.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.183 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.3 -39.63 92.74 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.648 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.49 93.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.545 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.66 -44.54 96.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.693 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.533 ' OH ' HD13 ' A' ' 45' ' ' LEU . 12.2 m-85 -69.49 -26.0 64.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.32 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.03 28.07 71.05 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 120.898 0.38 . . . . 0.0 110.68 179.899 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 98.3 mt . . . . . 0 C--O 1.233 0.213 0 CA-C-O 120.976 0.417 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.5 mt-10 -62.13 -30.39 71.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.579 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.1 mttt -62.93 -50.45 70.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.747 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 120' ' ' LEU . 32.5 mt -68.08 -43.83 77.63 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.882 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.0 t-105 -60.41 -51.3 70.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 -179.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.524 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -70.08 -37.55 75.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.026 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.759 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.5 OUTLIER -55.45 -50.87 68.71 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.463 -178.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.95 ' HB1' ' CG ' ' A' ' 130' ' ' PHE . . . -72.5 -46.93 52.4 Favored 'General case' 0 C--O 1.246 0.886 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.288 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.404 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 55.8 tttm -47.15 -33.91 5.64 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.46 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -106.15 -35.43 7.22 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.986 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.576 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 36.9 m -50.72 -24.84 3.69 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.279 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -153.89 -95.8 0.12 Allowed Glycine 0 CA--C 1.525 0.703 0 C-N-CA 119.686 -1.245 . . . . 0.0 111.824 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.738 ' O ' ' N ' ' A' ' 131' ' ' SER . 68.8 mttm -150.93 25.27 0.74 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.372 0.605 . . . . 0.0 110.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.95 ' CG ' ' HB1' ' A' ' 124' ' ' ALA . 21.9 m-85 -49.72 60.82 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.186 -1.37 . . . . 0.0 111.14 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.738 ' N ' ' O ' ' A' ' 129' ' ' LYS . 30.3 p -70.1 146.44 50.89 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.446 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . -37.03 -18.56 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.178 -173.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.632 ' N ' ' O ' ' A' ' 131' ' ' SER . 48.8 mt-10 -74.31 -46.14 42.9 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 118.927 -1.109 . . . . 0.0 108.497 176.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' A' ' 131' ' ' SER . 80.4 mm-40 -75.62 -42.36 51.85 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.354 178.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.882 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -60.07 -37.47 79.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.446 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 54.5 m-20 -61.92 -43.94 97.8 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.362 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -58.92 -45.16 91.05 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 119.881 -0.727 . . . . 0.0 109.9 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.489 HD13 ' OE2' ' A' ' 141' ' ' GLU . 4.5 mm? -61.01 -40.37 93.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 178.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.591 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -65.12 -31.53 72.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 176.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.567 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 84.5 mmt-85 -57.6 -48.51 79.19 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.245 -0.982 . . . . 0.0 108.358 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.83 ' OE1' HD21 ' A' ' 204' ' ' LEU . 9.4 pt-20 -71.46 -34.16 69.98 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.964 -0.694 . . . . 0.0 111.912 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.591 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.2 m-85 -56.15 -58.78 6.48 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.184 0.516 . . . . 0.0 110.242 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.41 -37.59 86.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.214 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 67.4 m170 -51.51 -42.7 61.9 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 119.677 -0.809 . . . . 0.0 109.388 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.88 -41.67 91.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.396 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -61.29 -44.15 97.7 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.31 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -68.05 -49.19 62.9 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -61.37 -42.91 99.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.606 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.06 -45.09 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.542 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.689 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.4 m170 -61.12 -35.96 78.45 Favored 'General case' 0 C--O 1.215 -0.742 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.294 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -65.21 -46.68 79.69 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.191 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.416 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 42.1 m-85 -65.69 -44.02 87.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.837 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -70.44 -45.2 66.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.667 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 150' ' ' HIS . 75.9 t -63.12 -45.96 97.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.905 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 73.4 mt . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.42 179.21 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 . . . . . 0 CA--C 1.522 -0.123 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.588 HD23 ' NZ ' ' A' ' 193' ' ' LYS . 8.5 mt -61.97 -47.85 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.592 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.465 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.7 mtpt -68.59 -40.88 80.32 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.438 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -68.76 -44.95 72.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.883 -178.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.588 ' NZ ' HD23 ' A' ' 190' ' ' LEU . 1.8 pttm -71.57 -44.46 64.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.233 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -69.36 -42.82 74.72 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.32 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.548 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.99 -37.56 88.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' ' 195' ' ' ARG . 69.3 m -62.18 -44.32 96.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -65.38 -43.71 94.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.983 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -63.06 -42.47 99.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.822 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -66.04 -33.12 75.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.334 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.95 -49.51 74.83 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.452 ' HA ' HD23 ' A' ' 201' ' ' LEU . 23.0 mt -63.49 -40.46 97.15 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.961 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.8 -37.41 84.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -42.83 99.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.238 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.83 HD21 ' OE1' ' A' ' 141' ' ' GLU . 21.0 mt -61.51 -41.48 97.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -64.52 -42.94 95.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.803 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.711 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -65.99 -40.29 91.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.565 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.521 ' O ' ' N ' ' A' ' 211' ' ' GLY . 22.0 t -63.65 -46.82 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.86 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.8 p -72.07 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.058 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -100.5 -14.76 18.12 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.318 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.711 ' N ' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -130.75 -39.53 1.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.045 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.503 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 219' ' ' GLU . 73.8 tt0 . . . . . 0 CA--C 1.531 0.228 0 CA-C-O 120.678 0.275 . . . . 0.0 110.72 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -61.33 139.86 94.66 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.521 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.425 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 68.9 Cg_endo -76.88 14.63 1.25 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.582 2.188 . . . . 0.0 111.919 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -105.94 -62.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.319 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.494 HG13 ' H ' ' A' ' 224' ' ' ILE . 0.5 OUTLIER -61.11 -55.31 25.48 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 CA-C-O 121.073 0.464 . . . . 0.0 111.619 -179.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.494 ' H ' HG13 ' A' ' 223' ' ' VAL . 2.9 mm -62.75 -41.5 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 47.8 t0 -62.58 -37.7 87.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.95 0.405 . . . . 0.0 109.938 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 6.0 tp -60.19 -43.49 95.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.449 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 46.2 m0 -60.26 -38.63 84.11 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.054 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . 0.511 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 45.1 t0 -61.64 -33.83 74.63 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 178.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.647 ' O ' ' N ' ' A' ' 232' ' ' SER . 38.6 mt -64.32 -40.08 95.19 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.071 0.463 . . . . 0.0 110.695 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.521 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -24.58 -51.77 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.092 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.511 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 2.3 pt20 -58.27 -44.81 88.57 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.232 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.647 ' N ' ' O ' ' A' ' 229' ' ' LEU . 9.9 m -79.97 -7.54 58.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.377 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -81.91 10.73 5.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.928 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.6 m120 67.56 91.28 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.31 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 79.7 mt -129.73 166.34 20.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.701 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.0 p -73.46 161.56 30.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.722 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -63.99 -46.28 85.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.57 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -62.68 -46.71 86.92 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.993 0.425 . . . . 0.0 110.524 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -67.44 -37.96 83.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.557 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -63.07 -42.58 99.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.731 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -64.77 -52.83 54.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.522 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.59 -37.77 76.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.468 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -66.7 -44.14 82.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.853 178.789 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -57.3 -47.93 80.22 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.902 0.382 . . . . 0.0 110.264 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.96 -38.81 83.22 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.814 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -60.02 -49.6 77.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.944 0.402 . . . . 0.0 110.492 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.505 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 4.0 mm? -63.78 -40.33 96.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.976 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.5 -44.25 84.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.923 0.392 . . . . 0.0 110.037 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -67.01 -41.16 87.17 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.714 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -59.4 -48.89 79.9 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 120.739 0.304 . . . . 0.0 111.282 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 12.4 pt-20 -65.1 -37.65 88.17 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.76 -40.08 88.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.743 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -62.85 -45.39 92.78 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.428 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -65.05 -40.3 88.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.079 -0.649 . . . . 0.0 109.832 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.81 -44.56 96.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -61.82 -42.41 98.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.102 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -56.11 -45.49 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.24 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . 0.401 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 53.8 t-20 -59.13 -41.95 89.47 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.362 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -59.02 -45.52 90.5 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.371 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -62.18 -38.26 88.41 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.148 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.503 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 61.4 mm-40 -59.7 -42.28 92.64 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.049 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -62.07 -47.74 83.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.419 -0.513 . . . . 0.0 109.848 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -65.24 -34.09 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.111 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.43 -42.13 99.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.89 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -64.19 -47.6 79.13 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.05 -43.42 99.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.1 -38.17 82.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.975 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.82 -44.29 97.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.955 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . 0.543 ' OE2' ' NE2' ' A' ' 273' ' ' HIS . 17.3 tp10 -59.83 -44.84 93.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.136 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.09 -39.43 89.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 28.3 tp -60.3 -44.75 95.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.072 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . 0.425 ' NH2' ' OE1' ' A' ' 269' ' ' GLU . 86.6 mtm180 -61.15 -42.07 97.89 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.095 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . 0.543 ' NE2' ' OE2' ' A' ' 269' ' ' GLU . 18.1 m170 -67.85 -43.09 80.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.214 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.64 84.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.886 0.374 . . . . 0.0 110.939 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -64.3 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 7.8 t -61.95 -20.44 63.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.78 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.458 HG12 ' H ' ' A' ' 279' ' ' ASP . 91.5 t -61.3 -46.26 96.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.884 0.373 . . . . 0.0 110.413 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.72 58.04 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . 0.458 ' H ' HG12 ' A' ' 277' ' ' VAL . 91.1 m-20 -68.07 -24.06 65.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.602 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 83.78 5.74 87.73 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . 0.681 ' C ' ' H ' ' A' ' 283' ' ' VAL . 75.0 mm-40 -82.91 156.92 23.28 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 110.026 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 61.2 -17.8 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.732 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . 0.681 ' H ' ' C ' ' A' ' 281' ' ' GLU . 73.7 t -63.25 -47.4 92.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.66 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 5.9 t -64.3 -46.22 84.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.485 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -62.96 -46.25 88.62 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.927 0.394 . . . . 0.0 110.79 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 m -61.58 -42.09 98.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.529 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -64.32 -39.03 93.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.38 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -60.71 -55.3 34.84 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.751 ' HD3' HD23 ' A' ' 292' ' ' LEU . 8.1 mmtp -64.02 -32.8 74.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.375 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . 0.572 ' CE1' ' OE2' ' A' ' 294' ' ' GLU . 19.9 t-80 -57.82 -49.86 75.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.351 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.27 -39.12 82.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.746 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.751 HD23 ' HD3' ' A' ' 289' ' ' LYS . 4.4 tp -61.5 -47.13 87.02 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.341 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 1.1 mt -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.058 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.572 ' OE2' ' CE1' ' A' ' 290' ' ' HIS . 92.1 mt-10 -64.2 -36.14 83.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.12 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.92 89.42 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . 0.521 ' NH1' ' OE1' ' A' ' 299' ' ' GLU . 14.2 tpp180 -62.81 -42.7 99.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.682 0.277 . . . . 0.0 110.744 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.503 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 23.4 p -59.06 -50.04 75.61 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.427 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -63.07 -43.2 99.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.529 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . 0.521 ' OE1' ' NH1' ' A' ' 296' ' ' ARG . 83.6 tt0 -62.0 -40.54 96.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.294 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.61 95.64 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.267 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.65 -41.59 97.46 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . 0.469 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 70.1 t80 -62.15 -45.54 92.96 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.53 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 8.9 m -60.44 -43.4 96.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.447 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.97 -43.25 91.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 52.0 tttp -56.32 -50.41 71.55 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.342 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . 0.469 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 30.9 mtpt -62.78 -42.35 99.66 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.49 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -61.78 -37.97 86.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.449 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 9.4 mt -61.02 -44.61 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.277 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -68.96 -45.69 70.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.068 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -62.73 -52.07 64.68 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.536 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.04 -38.7 91.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.504 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.0 m -58.38 -44.61 88.99 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.381 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -73.06 -47.28 24.83 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.135 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -63.6 -45.44 90.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.743 0.306 . . . . 0.0 110.521 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . 0.551 ' O ' ' C ' ' A' ' 316' ' ' SER . 2.5 mm -70.48 -27.02 29.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.576 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . 0.551 ' C ' ' O ' ' A' ' 315' ' ' ILE . 23.1 t -37.15 -48.62 0.84 Allowed 'General case' 0 CA--C 1.486 -1.517 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 . . . . . 0 N--CA 1.428 -1.557 0 C-N-CA 116.297 -2.161 . . . . 0.0 113.249 173.39 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.555 ' N ' ' OD1' ' A' ' 26' ' ' ASN . 33.5 m-85 . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.74 0.305 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.19 -19.1 61.79 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.826 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.463 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 99.2 mmm -135.1 148.0 49.69 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.242 0.544 . . . . 0.0 110.916 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -64.36 -37.16 86.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.486 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.7 -48.59 80.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.117 0.484 . . . . 0.0 110.45 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.16 -38.32 86.03 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.496 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.555 ' OD1' ' N ' ' A' ' 20' ' ' PHE . 58.1 m-80 -63.27 -39.94 95.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.196 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -61.65 -43.9 97.98 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.282 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 2.3 mm? -62.6 -43.17 99.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.514 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 48.0 t-105 -63.01 -50.63 69.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.469 0.652 . . . . 0.0 110.346 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -56.91 -39.05 73.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.846 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -61.07 -44.37 97.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.024 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.82 88.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.806 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.622 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 76.1 mt-30 -61.14 -38.24 85.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.946 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 mmm-85 -64.12 -39.27 93.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.545 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 35' ' ' LEU . 88.8 mt -66.04 -32.54 74.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.397 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.622 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 32.6 m170 65.86 113.87 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.752 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.2 mt -138.38 154.49 73.68 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.753 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -42.01 154.6 0.1 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.454 2.102 . . . . 0.0 112.321 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -69.41 -40.35 5.99 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.548 2.165 . . . . 0.0 112.454 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 63.1 t -63.21 -48.92 85.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.578 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -66.31 -39.42 89.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.447 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.26 -41.84 99.08 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.552 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.44 78.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.52 -42.63 87.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.9 tp -62.45 -47.46 83.94 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.152 0.501 . . . . 0.0 110.748 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.03 -41.57 96.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.273 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.565 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.16 -48.37 81.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.727 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -54.11 -48.5 70.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.865 0.364 . . . . 0.0 110.251 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.82 -40.07 83.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -59.94 -40.01 87.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.565 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.3 mm -62.53 -42.9 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.81 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.453 HE22 HD22 ' A' ' 81' ' ' LEU . 48.0 tt0 -59.67 -45.49 91.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.351 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -57.4 -48.0 80.22 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.346 0.593 . . . . 0.0 110.114 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -59.57 -43.97 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.311 0.577 . . . . 0.0 110.267 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -60.67 -40.16 91.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -58.29 -46.03 86.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.194 0.521 . . . . 0.0 109.848 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.87 -42.63 94.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.998 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.87 -45.2 95.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.549 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 82.2 t90 -56.09 -42.53 76.89 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.283 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.3 -45.95 91.58 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.205 0.526 . . . . 0.0 109.715 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -57.1 -44.63 83.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.11 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.3 mp -62.37 -40.11 95.36 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.021 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -56.46 -44.67 80.77 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 27.0 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.254 179.19 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.806 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -59.69 -39.1 83.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 110.201 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -56.93 -64.26 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.079 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -48.0 -40.38 22.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.216 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.33 86.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.225 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.7 ttt85 -61.34 -41.1 96.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.442 HD12 ' N ' ' A' ' 77' ' ' LEU . 11.0 mp -61.89 -44.15 97.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.146 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.41 -45.77 92.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.293 0.568 . . . . 0.0 109.97 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 83' ' ' VAL . 40.7 mmm-85 -61.79 -38.9 89.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.962 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.4 ' O ' HG13 ' A' ' 84' ' ' ILE . 38.0 t30 -64.02 -40.48 96.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.185 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.563 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -59.64 -49.86 76.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.311 0.577 . . . . 0.0 109.97 -179.392 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -66.17 -37.51 85.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.549 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.4 t -62.52 -46.57 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.653 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 80' ' ' ASN . 80.4 mt -61.35 -46.95 95.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.391 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 85' ' ' LEU . 29.6 mt -65.31 -39.35 92.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.911 0.386 . . . . 0.0 110.555 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.34 -48.21 82.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.866 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.405 ' HZ2' HG13 ' A' ' 83' ' ' VAL . 47.3 mttp -62.73 -45.33 93.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.776 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -64.35 -30.21 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.376 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.31 9.67 83.41 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 90' ' ' LEU . 95.8 mt . . . . . 0 C--N 1.333 -0.144 0 CA-C-O 120.811 0.338 . . . . 0.0 110.349 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 C--O 1.236 0.384 0 CA-C-O 121.081 0.467 . . . . 0.0 110.439 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.609 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.0 mt-10 -55.89 -24.86 39.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.428 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.55 -49.87 74.93 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.78 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.928 HD22 ' CZ ' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -71.42 -46.68 59.5 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.146 0.498 . . . . 0.0 111.782 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.718 ' CE3' HD22 ' A' ' 135' ' ' LEU . 19.3 t-105 -55.89 -46.06 78.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.506 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.609 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.3 m-70 -71.19 -34.07 70.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.539 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.577 ' O ' ' OG ' ' A' ' 127' ' ' SER . 10.3 tptt -55.54 -51.38 67.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.079 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -75.34 -47.15 29.05 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.974 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HB2' HD11 ' A' ' 135' ' ' LEU . 65.6 tttm -50.77 -39.55 52.69 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.747 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.3 m -94.1 -41.72 9.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.875 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.577 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 15.8 m -44.6 -27.11 0.44 Allowed 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.444 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -156.54 -97.08 0.13 Allowed Glycine 0 N--CA 1.462 0.373 0 C-N-CA 119.611 -1.281 . . . . 0.0 111.128 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.679 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.6 mttt -157.46 20.76 0.29 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.579 ' CE1' ' OE1' ' A' ' 134' ' ' GLU . 3.2 m-85 -60.12 50.05 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.671 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.679 ' N ' ' O ' ' A' ' 129' ' ' LYS . 0.1 OUTLIER -107.89 114.94 29.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.983 0.42 . . . . 0.0 111.705 -179.285 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.476 ' O ' ' HB3' ' A' ' 136' ' ' ASP . . . 120.51 -98.06 0.67 Allowed Glycine 0 CA--C 1.524 0.641 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.136 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.563 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 54.2 mp0 -78.79 -40.03 34.21 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.2 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.579 ' OE1' ' CE1' ' A' ' 130' ' ' PHE . 44.2 mt-10 -64.15 -43.55 94.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.563 0.697 . . . . 0.0 110.008 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.718 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -68.77 -35.62 77.29 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.275 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.517 ' CG ' ' N ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -62.36 -49.03 77.18 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.367 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 136' ' ' ASP . 18.6 ptpt -59.96 -38.52 82.73 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.478 ' N ' ' HG3' ' A' ' 137' ' ' LYS . 6.6 mt -59.84 -42.61 94.0 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.24 -39.19 78.64 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.583 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 81.9 mtp180 -54.45 -42.95 71.21 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.125 -1.03 . . . . 0.0 108.397 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -72.2 -39.4 68.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.728 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.928 ' CZ ' HD22 ' A' ' 120' ' ' LEU . 0.2 OUTLIER -59.76 -58.95 6.34 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.722 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.1 -41.01 97.76 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.583 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 36.4 m170 -57.62 -41.4 81.25 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.534 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.593 ' CE1' HG23 ' A' ' 197' ' ' ILE . 10.5 m-70 -64.33 -39.7 94.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.627 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -59.55 -47.64 84.75 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.488 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -68.43 -53.48 23.31 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.631 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.56 -40.93 96.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.997 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 145' ' ' HIS . 41.3 t -62.59 -44.17 99.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.173 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.689 ' C ' ' CD2' ' A' ' 150' ' ' HIS . 0.8 OUTLIER -65.58 -38.96 91.02 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.576 -0.85 . . . . 0.0 109.312 -178.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.68 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 97.1 mt-10 -58.87 -45.94 88.98 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.125 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.499 ' N ' ' HD1' ' A' ' 152' ' ' TYR . 2.5 m-85 -62.55 -43.6 98.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.654 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.99 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.049 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 150' ' ' HIS . 12.8 t -60.24 -46.4 94.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 0.0 110.643 179.79 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 . . . . . 0 CA--C 1.515 -0.389 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 4.6 mp -62.34 -41.89 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.033 0.444 . . . . 0.0 110.51 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -68.78 -33.78 74.46 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.846 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.609 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -67.8 -46.07 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.142 0.496 . . . . 0.0 111.685 -179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.413 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 pttt -72.03 -44.67 63.02 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.764 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.01 -41.3 97.51 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.558 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.609 ' HG3' ' O ' ' A' ' 192' ' ' GLU . 0.4 OUTLIER -66.04 -35.6 80.98 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.457 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 55.6 p -59.93 -39.68 86.33 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.593 HG23 ' CE1' ' A' ' 145' ' ' HIS . 70.2 mt -63.84 -43.59 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.26 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -62.25 -41.05 98.09 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.48 0.657 . . . . 0.0 109.303 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.554 ' NE2' ' NE ' ' A' ' 195' ' ' ARG . 86.1 mt-30 -61.95 -39.26 91.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.091 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.74 -39.63 95.54 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.72 -42.59 99.73 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.75 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 0.5 OUTLIER -63.1 -37.17 86.13 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.099 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.579 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 1.9 tmm_? -63.26 -41.75 99.08 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.325 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.83 -40.55 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.157 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.86 -43.68 98.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.511 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.682 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.1 mtt180 -63.7 -37.01 85.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.186 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.536 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 45.2 t -63.6 -45.33 97.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.093 0.473 . . . . 0.0 110.134 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -67.0 -29.38 69.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.63 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -94.32 -45.41 7.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.531 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 206' ' ' ARG . 46.1 tt0 -98.83 -31.4 11.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.141 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.536 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 . . . . . 0 N--CA 1.469 0.48 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.87 158.24 54.53 Favored Pre-proline 0 N--CA 1.464 0.24 0 C-N-CA 120.776 -0.369 . . . . 0.0 110.556 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -54.65 128.38 30.06 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.391 2.061 . . . . 0.0 112.087 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.665 ' HE ' HG23 ' A' ' 223' ' ' VAL . 62.7 ttp180 179.05 -95.88 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.519 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.665 HG23 ' HE ' ' A' ' 222' ' ' ARG . 5.0 t -61.53 -51.38 73.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-O 121.548 0.69 . . . . 0.0 110.585 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.421 HG13 ' CZ3' ' A' ' 227' ' ' TRP . 1.7 mt -66.05 -28.41 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.749 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -63.79 -40.7 97.29 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.464 ' HA ' HD12 ' A' ' 229' ' ' LEU . 13.7 mt -62.31 -40.94 97.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.026 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.547 ' CD1' ' N ' ' A' ' 227' ' ' TRP . 20.6 m0 -59.52 -38.6 81.39 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.095 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . 0.492 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 46.3 m-20 -63.5 -38.18 90.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.567 ' O ' ' N ' ' A' ' 232' ' ' SER . 89.1 mt -62.39 -41.55 98.74 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.129 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.481 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -32.75 -34.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.074 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.552 ' CG ' ' N ' ' A' ' 232' ' ' SER . 7.6 pt20 -66.26 -46.24 77.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.728 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.567 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.0 m -89.1 -6.75 56.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.362 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -72.99 9.54 1.15 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 232' ' ' SER . 58.8 t30 69.19 89.84 0.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.165 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.481 HD12 ' O ' ' A' ' 230' ' ' ALA . 79.6 mt -132.03 -173.25 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.687 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 62.1 p -84.38 164.77 18.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.6 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . 0.477 ' OD1' ' N ' ' A' ' 237' ' ' ASP . 21.7 p-10 -73.81 -46.2 46.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.61 -46.58 89.21 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.171 0.51 . . . . 0.0 110.469 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 243' ' ' PHE . 82.7 tt0 -61.22 -35.82 78.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.707 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 231' ' ' GLN . 2.8 mt -64.56 -39.76 94.33 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.69 -52.55 62.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.25 95.33 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.583 -0.447 . . . . 0.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.489 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.2 OUTLIER -70.02 -32.88 71.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.304 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -62.56 -55.75 24.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.125 0.488 . . . . 0.0 110.31 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -65.51 -37.46 86.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.541 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -56.76 -50.21 72.95 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.218 0.532 . . . . 0.0 110.377 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.514 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.0 mm? -63.96 -39.54 94.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.741 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -54.76 -47.27 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.146 0.498 . . . . 0.0 110.475 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -67.32 -39.39 85.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.614 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -59.69 -49.77 76.46 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.018 0.437 . . . . 0.0 111.364 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.0 pt-20 -63.72 -37.34 86.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.932 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.86 88.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -61.42 -51.47 68.62 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.093 0.473 . . . . 0.0 111.006 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -66.31 -35.35 74.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.201 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.72 -44.54 95.94 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.324 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.2 -43.96 97.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.02 -44.36 82.79 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.093 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -60.91 -40.49 93.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.45 -48.59 81.08 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 110.444 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -62.81 -35.66 80.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.619 HE21 ' CG2' ' A' ' 297' ' ' THR . 76.6 mm-40 -60.88 -44.48 97.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.183 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.98 -48.3 80.95 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.8 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -64.16 -34.1 77.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.866 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.25 -41.97 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.856 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.16 -45.5 84.68 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.554 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.2 mt -62.63 -43.4 98.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.118 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.36 88.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.209 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -60.92 -46.02 92.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.12 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.22 -45.99 91.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.136 0.493 . . . . 0.0 110.279 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.75 -40.14 94.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.447 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.722 ' O ' HD23 ' A' ' 271' ' ' LEU . 5.0 tt -59.17 -43.69 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.095 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -62.31 -41.08 98.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.269 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -66.81 -44.22 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.42 -36.92 85.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.627 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.03 -26.08 68.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 35.9 t -60.58 -39.83 89.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.376 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.42 -43.48 94.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.275 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.71 8.93 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -63.8 -42.88 97.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.732 0.301 . . . . 0.0 110.654 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 70.26 -3.85 9.96 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -96.98 -56.58 2.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 110.472 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -80.88 -15.95 54.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.746 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.51 -47.13 93.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.655 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 43.8 t -63.87 -43.99 94.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -59.73 -47.49 85.43 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.589 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . 0.45 ' OG ' HD12 ' A' ' 271' ' ' LEU . 15.2 t -63.03 -45.87 90.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -63.96 -38.82 92.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.669 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.97 -57.85 11.26 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.155 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.644 ' HD3' HD23 ' A' ' 292' ' ' LEU . 24.3 mmtt -64.32 -35.58 81.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.12 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -51.41 -52.95 41.6 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.268 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.25 -36.16 79.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.663 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.644 HD23 ' HD3' ' A' ' 289' ' ' LYS . 10.9 tp -60.74 -52.03 66.83 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.374 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 293' ' ' LEU . 14.8 tp -62.74 -42.85 99.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.451 0.643 . . . . 0.0 109.923 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.626 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.6 tt0 -64.7 -33.24 75.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.876 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -65.08 -47.58 80.29 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . 0.526 ' HG3' ' N ' ' A' ' 297' ' ' THR . 0.0 OUTLIER -62.36 -36.98 83.93 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.626 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 16.1 p -61.51 -44.11 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.43 -43.72 98.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.215 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.66 -37.7 88.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.122 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . 0.517 ' O ' HD13 ' A' ' 300' ' ' LEU . 0.2 OUTLIER -62.64 -44.46 96.23 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.1 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.31 99.57 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -60.22 -44.56 95.08 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.144 0.497 . . . . 0.0 110.365 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.0 m -61.04 -42.76 99.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.381 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.1 -43.16 88.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.031 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -59.91 -49.75 76.47 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.203 0.525 . . . . 0.0 110.464 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -63.3 -42.42 99.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.55 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.496 ' O ' ' HB2' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.35 -37.5 87.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.898 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.447 ' O ' ' CB ' ' A' ' 312' ' ' SER . 12.2 mt -61.52 -42.45 98.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.489 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -65.78 -60.75 2.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.96 0.41 . . . . 0.0 111.374 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -60.63 -48.34 82.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.392 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 307' ' ' HIS . 9.1 tp -61.72 -40.73 96.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.563 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 11.4 t -59.2 -44.69 92.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.346 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.35 -38.02 95.75 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -63.15 -45.05 93.7 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.6 mm -71.84 -25.52 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.88 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' A' ' 317' ' ' ARG . 28.0 p -44.03 -61.31 1.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.498 ' N ' ' OG ' ' A' ' 316' ' ' SER . 7.3 ptt-85 . . . . . 0 C--N 1.331 -0.224 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.461 0.107 0 CA-C-O 120.661 0.267 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -87.64 -12.2 46.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.512 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 78.5 mtp -119.42 138.5 53.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.109 0.48 . . . . 0.0 111.04 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -64.44 -36.53 84.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.44 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.94 -48.31 82.23 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.545 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.449 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.0 mp -61.73 -38.36 87.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.477 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.431 ' OD1' ' O ' ' A' ' 26' ' ' ASN . 55.5 t-20 -63.18 -39.24 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.094 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.8 tp60 -60.25 -46.55 89.41 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.348 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.72 -42.47 98.99 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.352 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -61.59 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.176 0.512 . . . . 0.0 110.533 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -58.46 -44.03 89.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.128 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.21 -41.59 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.367 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.0 88.48 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.075 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -62.06 -39.61 92.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.853 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -61.7 -41.49 97.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.347 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.16 -39.63 95.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.91 107.96 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.821 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -125.08 154.6 71.52 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.678 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.412 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 82.8 Cg_exo -42.93 154.88 0.13 Allowed 'Trans proline' 0 N--CA 1.492 1.382 0 C-N-CA 122.507 2.138 . . . . 0.0 112.372 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 32.2 Cg_exo -56.01 -43.81 53.16 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.585 2.19 . . . . 0.0 112.209 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.472 ' H ' HG22 ' A' ' 40' ' ' VAL . 2.8 m -67.36 -46.06 84.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.996 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.6 mmt85 -65.37 -42.1 93.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.805 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 tp -63.92 -43.99 94.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.593 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.79 -42.76 90.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.675 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -66.96 -46.24 75.27 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.3 tp -62.94 -45.7 91.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.359 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -59.5 -41.96 91.09 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.983 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.51 -47.36 85.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.657 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -57.0 -47.21 81.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.365 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.4 mt -57.06 -41.99 79.73 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.224 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.63 -38.79 85.96 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.228 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 47' ' ' ALA . 4.9 mm -61.34 -43.32 96.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.557 ' NE2' HD22 ' A' ' 80' ' ' ASN . 49.1 mm-40 -58.16 -47.66 82.68 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.622 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.26 -47.4 81.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.154 0.502 . . . . 0.0 110.237 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.47 HH11 ' HD3' ' A' ' 54' ' ' ARG . 39.3 mtp-105 -62.0 -41.97 98.63 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.611 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -63.59 -36.81 85.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.413 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -60.66 -49.19 78.53 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.012 0.434 . . . . 0.0 109.999 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.83 -41.18 97.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.259 -0.577 . . . . 0.0 110.089 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.56 96.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.7 t90 -59.7 -42.59 93.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.729 0.299 . . . . 0.0 110.45 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -60.49 -45.61 93.12 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.771 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -60.72 -41.81 96.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.839 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.4 mt -61.05 -41.23 96.21 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.8 -38.91 86.97 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.684 ' O ' HD23 ' A' ' 64' ' ' LEU . 4.3 tt . . . . . 0 C--N 1.329 -0.289 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.654 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.44 -37.75 87.11 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.451 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.416 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 87.4 mttt -54.4 -53.91 47.75 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.003 0.43 . . . . 0.0 110.122 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -60.92 -39.13 88.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.93 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.59 -39.88 95.13 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.475 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.416 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 81.6 mtm180 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.527 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 83.8 mt -63.09 -44.97 94.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.211 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.7 -46.34 89.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-O 121.152 0.501 . . . . 0.0 110.375 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.581 ' O ' HG23 ' A' ' 83' ' ' VAL . 18.6 tpt180 -60.09 -43.8 95.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.977 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.557 HD22 ' NE2' ' A' ' 52' ' ' GLN . 34.5 t30 -61.73 -40.09 93.86 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.448 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.606 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.73 -48.73 80.5 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.717 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -65.17 -38.17 89.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.507 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 79' ' ' ARG . 55.2 t -62.93 -46.89 95.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.493 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.19 -51.07 77.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.467 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.72 -41.07 96.24 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.888 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.96 92.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.523 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -62.63 -47.76 82.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.992 0.425 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -72.78 -22.18 60.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.126 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.45 25.13 73.48 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 90' ' ' LEU . 38.7 mt . . . . . 0 C--N 1.331 -0.206 0 CA-C-O 120.886 0.374 . . . . 0.0 110.537 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.1 mt . . . . . 0 C--O 1.235 0.322 0 CA-C-O 121.087 0.47 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.597 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.6 mt-10 -57.97 -25.96 61.69 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.599 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 70.1 mmtt -61.53 -54.75 39.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.703 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.61 -43.98 79.15 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.572 ' CE3' HD22 ' A' ' 135' ' ' LEU . 13.4 t-105 -58.84 -48.91 79.68 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.478 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.597 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.7 m-70 -70.04 -33.38 71.9 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.733 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.534 ' O ' ' OG ' ' A' ' 127' ' ' SER . 11.6 tptt -56.86 -51.27 69.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.718 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.91 -47.28 59.97 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 119.596 -0.841 . . . . 0.0 111.086 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -53.71 -51.48 63.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.918 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.2 m -75.25 -43.27 52.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.73 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 9.6 m -44.48 -30.9 0.95 Allowed 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -160.54 -96.55 0.11 Allowed Glycine 0 CA--C 1.517 0.166 0 C-N-CA 119.48 -1.343 . . . . 0.0 111.526 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.693 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.6 mttt -153.63 21.43 0.53 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -59.14 50.56 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.511 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.693 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.8 p -109.17 135.4 50.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.348 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 96.43 -96.62 1.93 Allowed Glycine 0 CA--C 1.526 0.728 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.908 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.546 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 56.6 mp0 -72.71 -43.79 62.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.342 . . . . 0.0 111.166 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.514 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 46.9 mp0 -63.97 -51.77 62.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.023 0.439 . . . . 0.0 110.404 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.572 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.8 mt -61.56 -39.69 92.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.673 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -60.32 -42.81 96.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.975 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -62.04 -41.4 98.07 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 110.094 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.51 HD13 ' O ' ' A' ' 134' ' ' GLU . 9.4 mp -59.81 -41.81 92.07 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.415 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -66.54 -35.44 80.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 176.687 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.421 ' O ' ' CD2' ' A' ' 144' ' ' HIS . 69.9 mtp180 -55.31 -43.27 74.7 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.233 178.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.736 ' OE1' HD21 ' A' ' 204' ' ' LEU . 96.5 mt-10 -71.18 -41.19 70.65 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.824 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.415 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 3.6 m-85 -60.46 -54.93 39.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.793 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.02 -39.59 90.33 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.937 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.421 ' CD2' ' O ' ' A' ' 140' ' ' ARG . 4.1 m170 -56.16 -42.68 77.41 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.578 ' CE1' HG23 ' A' ' 197' ' ' ILE . 5.7 m-70 -63.05 -40.78 98.73 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.425 178.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -61.49 -42.93 99.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.884 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.704 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 98.7 mt-10 -67.97 -46.25 71.9 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 111.555 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -70.83 -43.93 67.55 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.55 -50.62 77.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.725 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -70.08 -23.87 63.14 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.59 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.686 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 19.8 mm-40 -68.18 -45.0 74.64 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.404 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 16.8 m-85 -62.78 -45.35 93.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -65.5 -41.03 93.66 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.583 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 150' ' ' HIS . 35.2 t -61.94 -46.33 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.0 0.429 . . . . 0.0 110.286 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 81.2 mt . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.513 179.746 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 CA--C 1.521 -0.162 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.502 HD23 ' NZ ' ' A' ' 193' ' ' LYS . 11.4 mt -60.93 -46.86 88.98 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.539 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.555 ' HB3' HH21 ' A' ' 195' ' ' ARG . 56.5 mtpt -74.36 -32.52 62.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 11.2 tm-20 -68.08 -44.81 75.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.364 . . . . 0.0 111.296 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.502 ' NZ ' HD23 ' A' ' 190' ' ' LEU . 17.4 pttt -73.47 -43.91 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.173 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.724 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.83 -40.83 88.12 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.854 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.555 HH21 ' HB3' ' A' ' 191' ' ' LYS . 17.9 ptp180 -67.36 -38.19 84.39 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.447 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.3 p -60.31 -41.15 92.88 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.578 HG23 ' CE1' ' A' ' 145' ' ' HIS . 92.1 mt -64.3 -44.63 97.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.452 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.75 -40.85 98.53 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.961 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.403 ' HA ' ' OD2' ' A' ' 202' ' ' ASP . 89.4 mm-40 -60.4 -41.3 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.688 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.92 -40.15 98.48 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 201' ' ' LEU . 36.2 mt -62.04 -42.86 99.63 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.109 179.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.538 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.4 OUTLIER -64.14 -35.27 80.23 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.474 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.3 tmt_? -60.98 -43.77 98.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.739 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.736 HD21 ' OE1' ' A' ' 141' ' ' GLU . 31.6 mt -62.26 -40.25 95.58 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -64.99 -45.08 87.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.991 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' A' ' 210' ' ' GLN . 82.7 mtp180 -65.21 -44.43 88.36 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.146 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.459 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -68.31 -40.87 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.131 0.491 . . . . 0.0 110.345 -179.459 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . 0.444 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 68.4 m -60.28 -37.91 81.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.473 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -95.42 -46.66 6.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.636 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 206' ' ' ARG . 54.9 tt0 -81.3 -35.65 30.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.109 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.519 0.297 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.84 ' O ' HG11 ' A' ' 223' ' ' VAL . 2.7 tm-20 . . . . . 0 CA--C 1.502 -0.873 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.507 ' O ' ' CG1' ' A' ' 223' ' ' VAL . 4.2 mp0 61.56 148.19 0.09 OUTLIER Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.226 -177.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.475 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 74.3 Cg_endo -79.3 169.99 18.11 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.396 2.064 . . . . 0.0 111.759 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 89.6 mtm180 69.59 -46.77 0.59 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.517 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 1.018 HG13 ' H ' ' A' ' 224' ' ' ILE . 3.4 p -57.64 -97.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.798 0 CA-C-O 121.458 0.647 . . . . 0.0 111.831 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 1.018 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.3 OUTLIER -42.92 -29.07 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.333 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 223' ' ' VAL . 98.5 m-20 -62.51 -44.84 95.37 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 223' ' ' VAL . 1.5 mp -59.99 -40.18 88.28 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.557 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 33.3 m0 -59.68 -43.0 94.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.783 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -67.75 -27.26 66.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 2.0 mt -63.08 -46.27 88.18 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.411 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.537 ' O ' ' C ' ' A' ' 231' ' ' GLN . . . -35.54 -67.25 0.16 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.814 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.537 ' C ' ' O ' ' A' ' 230' ' ' ALA . 12.8 tt0 24.62 -103.73 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.937 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.0 p -113.47 27.84 9.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.331 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.86 81.85 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.327 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -175.34 72.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.682 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 96.3 mt -134.61 -169.25 2.3 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.741 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.414 ' OG1' ' OE1' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -110.46 -152.56 0.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.764 -178.902 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -92.53 -59.54 2.05 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.117 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.08 -42.8 99.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . 0.414 ' OE1' ' OG1' ' A' ' 236' ' ' THR . 89.2 mt-10 -60.18 -34.0 72.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.602 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.681 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -62.75 -44.4 96.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.292 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -64.89 -47.73 76.74 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.665 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.25 99.2 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.785 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.511 ' O ' ' HG2' ' A' ' 246' ' ' GLU . 1.3 t80 -61.82 -47.58 84.47 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.007 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.25 -42.53 98.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.572 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -59.09 -57.88 11.1 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.396 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 243' ' ' PHE . 13.3 pt-20 -58.99 -38.87 80.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.948 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 1.9 mm? -61.55 -41.98 98.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.381 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.408 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 65.9 tttm -61.09 -42.23 98.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.157 0.503 . . . . 0.0 109.858 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -65.91 -39.5 90.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.801 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -61.84 -48.49 80.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.562 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 13.7 pt-20 -62.01 -41.87 98.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.079 0.466 . . . . 0.0 110.114 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -62.83 -38.2 89.82 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.152 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -61.96 -62.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.247 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.13 -37.21 13.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.03 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -65.35 -46.35 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.688 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -62.98 -43.31 99.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -58.07 -43.87 87.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.863 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.11 -40.65 94.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.252 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . 0.422 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 83.1 t60 -59.18 -47.61 84.67 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.297 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -62.7 -37.43 86.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.363 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -57.77 -47.66 81.88 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 120.993 0.425 . . . . 0.0 110.4 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -61.76 -43.24 99.25 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.042 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . 0.422 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 4.6 mp0 -60.46 -39.02 86.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.902 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . 0.403 HD21 ' HB3' ' A' ' 293' ' ' LEU . 38.0 mt -61.98 -41.84 98.48 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.338 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.92 -48.02 83.75 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-O 121.118 0.485 . . . . 0.0 110.44 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.3 mt -63.03 -43.49 99.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.157 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.12 85.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.27 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.53 -47.73 84.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.222 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -63.31 -45.0 93.37 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.992 0.425 . . . . 0.0 110.676 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -61.33 -42.88 99.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.469 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.668 ' O ' HD23 ' A' ' 271' ' ' LEU . 1.8 tt -60.8 -42.66 98.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.907 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -59.69 -44.07 93.78 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.257 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -71.59 -34.05 69.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.88 0.371 . . . . 0.0 110.509 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.581 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.84 -37.24 86.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.07 -25.36 66.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.871 0.367 . . . . 0.0 110.537 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 67.4 m -87.95 2.72 50.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.874 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.583 HG13 ' N ' ' A' ' 278' ' ' GLY . 11.0 p -60.47 -44.47 96.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.652 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.583 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 156.9 -99.26 0.18 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -61.97 -40.93 97.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 0.0 110.258 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.5 32.81 40.9 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -66.68 -36.8 83.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.836 0.351 . . . . 0.0 110.738 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -77.49 -6.75 54.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.99 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.99 -44.99 99.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.8 t -60.5 -45.32 94.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.149 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.96 -45.84 93.14 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.992 0.425 . . . . 0.0 110.756 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 50.5 m -60.63 -41.9 95.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.182 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -62.23 -40.6 96.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.587 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.02 -57.02 14.93 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.671 ' HD3' HD23 ' A' ' 292' ' ' LEU . 15.0 mmtm -64.62 -35.93 82.6 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.304 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -52.68 -46.99 67.47 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.47 -37.66 80.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.47 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.671 HD23 ' HD3' ' A' ' 289' ' ' LYS . 19.6 tp -61.25 -51.12 70.25 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.712 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . 0.403 ' HB3' HD21 ' A' ' 264' ' ' LEU . 10.2 mp -63.56 -41.29 98.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.044 0.45 . . . . 0.0 109.979 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -65.34 -35.04 79.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.077 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.5 -50.07 67.92 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -62.17 -42.74 99.55 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.611 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.4 m -61.28 -48.71 80.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.472 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.33 -41.93 98.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.171 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -62.28 -40.23 95.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.1 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -43.63 98.32 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.128 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.68 98.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.72 -44.61 96.58 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.043 0.449 . . . . 0.0 110.513 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.4 m -60.28 -44.44 95.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.449 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.09 -42.54 90.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.926 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.56 -51.38 70.15 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 110.809 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.67 -43.41 96.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.24 -36.41 83.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.993 0.425 . . . . 0.0 109.981 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.557 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 12.2 mt -60.35 -44.55 95.45 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.138 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . 0.403 ' O ' ' OG ' ' A' ' 312' ' ' SER . 96.5 mm-40 -70.91 -57.3 4.72 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.543 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.86 -49.9 75.62 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.676 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 12.9 tp -62.59 -41.63 99.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.508 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 37.5 p -59.47 -40.59 87.43 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.439 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.93 -41.06 95.6 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -61.74 -44.62 96.55 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.724 -0.28 . . . . 0.0 110.86 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 2.7 mm -65.01 -41.99 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.0 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.6 t -47.65 -42.67 24.99 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 . . . . . 0 C--N 1.327 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.281 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 . . . . . 0 N--CA 1.46 0.049 0 CA-C-O 120.682 0.277 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -62.85 -34.8 78.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.06 147.51 46.01 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.744 0.783 . . . . 0.0 111.222 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -63.57 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.557 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -55.57 -48.61 74.51 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.388 0.613 . . . . 0.0 109.954 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.74 -38.78 91.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.327 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -62.63 -39.03 92.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.573 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.78 -47.28 87.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.511 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.425 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.8 mm? -60.64 -41.85 95.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.048 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.491 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 49.5 t-105 -60.03 -45.23 93.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.282 0.563 . . . . 0.0 110.435 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -56.9 -43.76 81.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.153 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -60.62 -41.72 95.39 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.338 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.95 86.78 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.076 0.465 . . . . 0.0 110.046 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.491 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 76.5 mt-30 -62.6 -37.86 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -60.6 -43.9 96.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.401 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.12 -38.89 92.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.57 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.87 105.66 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.756 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -127.53 154.39 77.51 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.631 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -38.57 155.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.791 2.327 . . . . 0.0 112.144 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.37 -43.25 18.67 Favored 'Trans proline' 0 C--N 1.307 -1.639 0 C-N-CA 122.675 2.25 . . . . 0.0 112.403 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 76.9 t -63.66 -47.16 92.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.472 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -64.08 -41.75 97.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.3 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.68 ' C ' HD23 ' A' ' 42' ' ' LEU . 8.5 tt -61.93 -43.47 98.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.33 -41.54 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.234 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.51 -44.66 74.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.1 tp -62.73 -49.2 75.98 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.961 0.41 . . . . 0.0 110.462 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -59.81 -42.06 92.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.47 -38.93 93.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.606 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -60.34 -52.42 65.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.096 0.474 . . . . 0.0 110.455 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.01 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.253 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.09 -45.73 83.14 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.286 0.565 . . . . 0.0 110.187 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.38 -42.78 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.661 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 tp60 -52.97 -41.83 64.95 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -63.43 -40.74 97.98 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -61.51 -43.58 98.61 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.467 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -60.54 -42.23 96.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.539 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.56 -47.59 79.14 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.323 0.583 . . . . 0.0 109.889 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.54 -39.74 88.99 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.34 0.59 . . . . 0.0 109.811 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.72 87.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.612 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 68.7 t90 -57.21 -39.92 76.42 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -58.42 -46.69 85.98 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.24 -43.52 96.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.308 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -62.19 -40.41 95.97 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.015 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -58.5 -43.62 89.14 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.1 mt . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.775 179.344 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.849 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.55 -37.62 88.03 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.439 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -60.42 -47.11 87.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.067 0.461 . . . . 0.0 110.251 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -59.81 -43.5 94.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.363 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.69 -37.95 86.01 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.522 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.05 -41.69 99.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.89 -43.73 95.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.29 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.22 -44.5 97.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.076 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.616 ' O ' HG23 ' A' ' 83' ' ' VAL . 44.9 ttm180 -59.09 -42.45 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.063 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -62.72 -40.46 97.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.556 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.671 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.41 -48.45 80.61 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.89 -179.574 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -64.9 -38.88 92.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.659 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 79' ' ' ARG . 61.4 t -62.52 -46.4 96.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 94.1 mt -60.49 -48.2 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.066 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' A' ' 85' ' ' LEU . 22.7 mt -65.01 -40.86 95.54 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.068 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.37 -47.35 85.76 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.805 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.14 -47.58 82.14 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.116 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -66.15 -27.22 67.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.448 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 68.27 24.98 74.83 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 90' ' ' LEU . 97.2 mt . . . . . 0 C--N 1.33 -0.254 0 CA-C-O 120.831 0.348 . . . . 0.0 110.827 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.581 ' N ' HD12 ' A' ' 117' ' ' LEU . 7.2 mp . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.942 0.401 . . . . 0.0 110.612 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.617 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.5 mt-10 -60.45 -32.65 71.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.642 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.4 mtmt -62.09 -45.91 91.43 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.905 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 47.6 mt -69.02 -46.59 67.58 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.552 ' CE3' HD22 ' A' ' 135' ' ' LEU . 8.4 t-105 -62.95 -44.47 95.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.542 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.617 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -69.47 -38.94 77.95 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.164 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.521 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.0 mptt -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.173 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.464 ' HB1' ' HB2' ' A' ' 130' ' ' PHE . . . -70.26 -45.57 66.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.791 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.482 ' HB2' HD11 ' A' ' 135' ' ' LEU . 65.3 tttm -48.25 -46.08 35.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.136 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 18.2 m -109.65 -60.2 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.643 -0.423 . . . . 0.0 112.005 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.64 -11.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.748 -178.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.432 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -134.13 -3.74 3.09 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 56.91 12.75 1.27 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.265 0.555 . . . . 0.0 109.756 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.464 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 6.0 m-30 -68.86 50.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.669 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 5.6 p -96.15 118.15 32.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.731 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 119.93 -97.97 0.69 Allowed Glycine 0 CA--C 1.53 0.979 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.492 178.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -78.85 -43.57 24.81 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.268 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.487 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.0 mp0 -60.67 -47.39 86.48 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.555 -0.458 . . . . 0.0 109.851 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.552 HD22 ' CE3' ' A' ' 121' ' ' TRP . 2.0 mt -62.87 -41.62 99.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.018 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.39 -40.57 94.83 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.999 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.6 -42.27 99.47 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.077 0.465 . . . . 0.0 110.173 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.59 -43.97 93.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.444 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -67.06 -37.7 84.48 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 144' ' ' HIS . 52.6 mtp180 -53.32 -43.93 68.01 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.721 ' OE1' HD21 ' A' ' 204' ' ' LEU . 97.8 mt-10 -71.5 -40.85 69.92 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.669 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.444 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.9 m-85 -59.01 -57.91 10.99 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.568 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 44.3 mt -60.72 -39.06 87.22 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.299 -0.561 . . . . 0.0 110.254 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.44 ' CD2' ' O ' ' A' ' 140' ' ' ARG . 4.0 m170 -51.32 -48.05 62.49 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -63.27 -39.86 95.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.664 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt -61.04 -41.56 96.81 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.318 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -67.68 -53.11 30.36 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 120.77 0.319 . . . . 0.0 111.577 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -61.3 -44.04 97.87 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.808 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.4 t -62.08 -43.86 98.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.747 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.682 ' O ' ' OD1' ' A' ' 153' ' ' ASN . 2.3 m170 -60.14 -41.59 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.56 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -64.79 -37.82 88.9 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.514 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -68.39 -50.67 51.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.131 0.491 . . . . 0.0 111.141 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . 0.804 ' OD1' ' N ' ' A' ' 154' ' ' VAL . 56.5 p30 -72.45 -38.43 68.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.865 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.804 ' N ' ' OD1' ' A' ' 153' ' ' ASN . 40.1 t -61.02 -46.45 96.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 155' ' ' LEU . 71.4 mt . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.401 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 . . . . . 0 CA--C 1.519 -0.218 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.554 ' HA ' ' HZ2' ' A' ' 193' ' ' LYS . 9.5 mp -62.12 -42.92 99.71 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.623 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.525 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 23.7 mmtp -67.51 -39.54 85.14 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 83.0 tt0 -67.79 -47.68 68.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.997 0.427 . . . . 0.0 111.66 -179.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.554 ' HZ2' ' HA ' ' A' ' 190' ' ' LEU . 1.0 OUTLIER -73.13 -43.12 62.08 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.415 -179.315 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.741 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.94 -42.09 77.21 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.053 -179.648 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.59 ' CZ ' HE22 ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.51 -39.25 93.43 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.43 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 49.9 m -60.46 -43.76 96.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.41 -43.23 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.9 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -62.3 -41.53 98.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.847 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.59 HE22 ' CZ ' ' A' ' 195' ' ' ARG . 84.1 mt-30 -63.6 -38.52 91.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.579 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.87 -48.83 84.13 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.8 mt -62.84 -39.71 95.22 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.129 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.566 ' HB3' HH12 ' A' ' 206' ' ' ARG . 48.8 m-20 -62.31 -37.45 85.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.482 0.658 . . . . 0.0 109.419 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.419 ' HD2' ' C ' ' A' ' 203' ' ' ARG . 4.1 tmm_? -61.66 -41.96 98.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.145 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.721 HD21 ' OE1' ' A' ' 141' ' ' GLU . 21.5 mt -61.14 -39.62 90.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.434 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -60.95 -43.72 98.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.746 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.68 ' O ' ' N ' ' A' ' 210' ' ' GLN . 84.7 mtt85 -64.54 -39.8 94.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.234 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.604 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.1 t -63.62 -45.58 97.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.077 0.465 . . . . 0.0 110.236 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.06 -29.55 64.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.72 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -96.85 -16.75 20.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.274 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.68 ' N ' ' O ' ' A' ' 206' ' ' ARG . 18.8 mm100 -127.66 -37.89 1.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.781 0.324 . . . . 0.0 110.697 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.604 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.539 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.569 ' HB3' HG11 ' A' ' 223' ' ' VAL . 47.6 tp10 . . . . . 0 N--CA 1.448 -0.552 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.666 ' O ' HG12 ' A' ' 223' ' ' VAL . 18.2 tt0 -170.21 131.39 0.95 Allowed Pre-proline 0 CA--C 1.533 0.305 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.778 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.419 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 76.5 Cg_exo -47.17 79.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.668 2.245 . . . . 0.0 112.233 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.564 ' N ' ' O ' ' A' ' 220' ' ' GLU . 0.7 OUTLIER 165.38 -46.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.606 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 1.046 HG13 ' H ' ' A' ' 224' ' ' ILE . 2.1 p -61.48 -84.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.42 0.629 . . . . 0.0 111.228 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 1.046 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.1 mp -52.97 -26.66 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.062 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -63.15 -46.45 87.12 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.326 0.584 . . . . 0.0 109.864 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 17.5 mt -61.76 -40.75 96.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.362 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.437 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 40.8 m0 -61.24 -37.1 81.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.957 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . 0.498 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 66.4 t0 -63.48 -37.17 86.28 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' A' ' 230' ' ' ALA . 95.7 mt -64.53 -42.24 95.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.442 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.587 ' O ' ' N ' ' A' ' 233' ' ' ALA . . . -29.97 -70.25 0.06 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.298 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 4.1 pt20 -38.0 -47.82 1.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.444 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.443 ' N ' ' O ' ' A' ' 229' ' ' LEU . 6.2 m -86.17 31.88 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.357 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . 0.587 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -150.51 111.06 4.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . 0.666 ' O ' ' HB2' ' A' ' 235' ' ' LEU . 65.0 t30 48.12 -142.6 0.48 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.228 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' A' ' 234' ' ' ASN . 60.6 mt 85.93 148.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.926 0.766 . . . . 0.0 110.746 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.624 ' H ' ' CD ' ' A' ' 239' ' ' GLU . 0.9 OUTLIER -100.23 -119.86 0.16 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.511 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . 0.568 ' N ' ' OE1' ' A' ' 239' ' ' GLU . 32.6 p-10 -122.06 -62.49 1.39 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.864 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.67 -42.16 99.48 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.185 0.517 . . . . 0.0 110.794 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . 0.624 ' CD ' ' H ' ' A' ' 236' ' ' THR . 3.2 pm0 -58.5 -29.19 66.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.691 179.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.588 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -67.17 -57.89 5.9 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.002 -179.153 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -55.37 -49.45 72.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.515 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.41 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.059 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 1.5 t80 -62.12 -44.86 95.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.238 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 59.4 ttm-85 -57.9 -48.54 79.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.972 0.415 . . . . 0.0 110.355 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.5 -39.27 85.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.628 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -58.9 -55.02 40.57 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.331 0.586 . . . . 0.0 110.344 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.443 ' N ' ' CD2' ' A' ' 247' ' ' LEU . 3.9 mm? -63.91 -34.31 77.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.71 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.7 tttt -57.73 -43.15 85.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 110.265 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -68.57 -43.59 76.25 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.351 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.6 -47.66 82.8 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.504 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.71 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.5 pp20? -60.82 -38.0 83.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.079 0.466 . . . . 0.0 109.756 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.01 -39.07 89.96 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.495 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -63.17 -47.43 82.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.487 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.446 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.3 tt -63.36 -34.83 69.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.072 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.77 -45.44 89.76 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.179 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.02 -43.35 99.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.139 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -43.44 79.41 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.015 0.436 . . . . 0.0 109.976 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -61.02 -41.29 96.27 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.311 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -58.93 -46.28 88.36 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.107 0.479 . . . . 0.0 110.355 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -61.18 -40.84 95.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.119 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.682 HE21 ' CG2' ' A' ' 297' ' ' THR . 88.2 mm-40 -56.47 -44.15 80.29 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.011 0.434 . . . . 0.0 110.089 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.3 -45.32 94.97 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.059 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -60.06 -38.32 82.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.11 -42.39 99.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.373 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -61.17 -47.55 85.67 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.058 0.456 . . . . 0.0 110.476 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.239 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.68 88.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -60.53 -49.21 78.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.357 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -62.7 -44.87 95.13 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.53 -39.8 92.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.566 HD21 ' OE2' ' A' ' 275' ' ' GLU . 4.2 tt -60.72 -45.43 94.26 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.448 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -61.78 -40.23 94.44 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.55 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 12.1 m80 -71.34 -41.39 69.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.914 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -67.97 -41.64 82.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.985 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . 0.566 ' OE2' HD21 ' A' ' 271' ' ' LEU . 92.5 mt-10 -56.94 -17.62 10.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.57 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 29.5 m -61.16 -43.99 98.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.628 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.519 HG13 ' N ' ' A' ' 279' ' ' ASP . 2.1 p -66.87 -35.9 75.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.507 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 76.69 37.65 34.0 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . 0.519 ' N ' HG13 ' A' ' 277' ' ' VAL . 59.9 t0 -59.79 -44.0 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.845 0.355 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 81.87 -4.12 76.51 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -94.04 -69.9 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.905 0.383 . . . . 0.0 110.375 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -70.77 -20.84 62.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.773 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 58.6 t -62.04 -47.83 91.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.587 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 46.5 t -63.94 -44.53 92.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.047 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.8 -42.31 99.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.649 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . 0.421 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 39.9 t -62.32 -46.72 87.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.628 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -64.58 -39.55 93.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.949 0.404 . . . . 0.0 110.742 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -58.66 -58.11 10.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.153 0.502 . . . . 0.0 110.167 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.491 ' HD3' HD23 ' A' ' 292' ' ' LEU . 35.2 mmtt -64.47 -31.98 73.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.901 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . 0.421 ' HB2' ' O ' ' A' ' 286' ' ' SER . 58.1 t-80 -54.49 -51.34 65.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.865 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.32 82.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.462 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.491 HD23 ' HD3' ' A' ' 289' ' ' LYS . 15.6 tp -62.04 -49.63 75.24 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.779 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.85 -41.67 99.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.941 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.465 ' O ' ' OG1' ' A' ' 297' ' ' THR . 68.8 mm-40 -61.09 -38.06 84.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.078 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.9 -45.22 96.13 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 16.8 tpp85 -61.21 -43.46 98.85 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.693 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.682 ' CG2' HE21 ' A' ' 261' ' ' GLN . 31.5 p -60.22 -43.5 95.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.433 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -63.89 -45.12 90.8 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.449 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.39 -40.78 97.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.267 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -44.08 97.64 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.186 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.8 -41.28 97.55 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -61.35 -46.03 91.94 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.157 0.503 . . . . 0.0 110.719 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . 0.484 HG22 ' ND1' ' A' ' 307' ' ' HIS . 19.7 m -60.8 -44.38 96.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.56 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -61.08 -43.16 95.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.346 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.22 -49.55 76.66 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.111 0.481 . . . . 0.0 110.803 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -62.13 -44.37 96.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.458 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.484 ' ND1' HG22 ' A' ' 303' ' ' THR . 19.4 m80 -66.82 -31.09 71.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.151 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.552 HD21 HG23 ' A' ' 223' ' ' VAL . 0.5 OUTLIER -60.07 -47.9 83.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.064 -179.6 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.49 -44.14 71.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.808 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -59.68 -51.93 67.67 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.013 0.435 . . . . 0.0 111.089 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 315' ' ' ILE . 36.4 mt -62.57 -48.21 80.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.783 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 8.0 m -69.52 -12.89 62.02 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.693 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -79.57 -64.43 1.9 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 89.5 mmt-85 -68.76 -37.6 79.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.01 0.405 . . . . 0.0 110.972 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 311' ' ' LEU . 1.2 mm -57.5 -19.88 12.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.748 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . 0.467 ' C ' ' O ' ' A' ' 315' ' ' ILE . 82.0 p -36.67 -33.8 0.06 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 315' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.53 0.203 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.924 177.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.673 0.273 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.507 HH21 ' CD ' ' A' ' 53' ' ' GLU . 80.4 mtm180 -64.19 -36.61 84.62 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.505 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 30.6 mtp -125.0 147.88 48.73 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.648 0.737 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.772 ' CD ' ' H ' ' A' ' 23' ' ' GLU . 2.0 pm0 -59.15 -32.03 69.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.86 -50.13 73.39 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.31 0.576 . . . . 0.0 110.588 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.8 mp -61.33 -38.74 87.99 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.286 179.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.414 ' OD1' ' O ' ' A' ' 26' ' ' ASN . 55.1 t-20 -63.45 -37.6 87.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.333 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.36 -48.25 82.55 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.297 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.1 mm? -61.06 -42.43 98.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.115 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.567 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 54.6 t-105 -61.81 -43.53 98.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -57.55 -44.25 85.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.207 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -61.42 -41.29 96.93 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.107 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.11 87.2 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.147 0.498 . . . . 0.0 110.129 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.567 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -63.43 -37.68 88.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.075 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -59.91 -44.37 94.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.317 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.36 -39.65 94.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.381 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.46 104.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.798 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.7 mt -121.95 154.3 61.01 Favored Pre-proline 0 C--O 1.233 0.214 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.616 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -40.53 154.11 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.513 2.142 . . . . 0.0 112.377 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.5 -43.67 49.15 Favored 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.521 2.147 . . . . 0.0 112.62 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -48.34 88.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.812 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -66.23 -38.54 88.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.564 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.9 tt -63.63 -43.56 96.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.66 -47.87 76.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.757 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -66.71 -41.81 87.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.614 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.507 HD13 ' OH ' ' A' ' 88' ' ' TYR . 51.4 tp -62.54 -48.57 78.92 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.541 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -60.25 -41.63 93.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.289 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.4 90.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.744 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.409 ' OD1' ' C ' ' A' ' 48' ' ' ASP . 61.3 t0 -60.4 -53.28 59.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.394 . . . . 0.0 110.688 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.86 -39.68 95.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.206 0.527 . . . . 0.0 110.487 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -56.8 -46.79 81.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.133 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.09 -42.49 96.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.679 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -49.57 -45.58 47.9 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.507 ' CD ' HH21 ' A' ' 21' ' ' ARG . 42.1 tp10 -66.99 -36.47 82.24 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.359 -0.537 . . . . 0.0 109.599 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.59 -46.41 89.96 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -64.24 -40.08 95.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.503 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.6 -49.75 74.01 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.983 0.42 . . . . 0.0 110.259 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.82 -42.34 97.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.861 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.78 96.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -57.09 -42.66 81.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.202 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.59 -45.25 94.68 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.72 -45.43 81.89 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.256 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mp -62.36 -42.29 99.28 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.996 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -55.83 -43.99 77.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 41.1 tp . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.757 179.116 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.527 0.833 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -69.29 -36.95 77.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.737 0.303 . . . . 0.0 110.326 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -59.99 -59.58 5.19 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.961 0.41 . . . . 0.0 110.553 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 16.4 pt-20 -57.19 -40.03 76.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.129 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.41 ' N ' ' HG3' ' A' ' 74' ' ' GLU . . . -59.6 -41.31 90.06 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.257 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -63.15 -42.28 99.42 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 77' ' ' LEU . 92.4 mt -63.63 -43.68 96.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.161 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.57 -45.48 97.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.312 0.577 . . . . 0.0 110.06 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.605 ' O ' HG23 ' A' ' 83' ' ' VAL . 42.3 ttm180 -59.46 -43.1 93.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.135 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.417 ' O ' HG13 ' A' ' 84' ' ' ILE . 96.0 m-20 -62.09 -39.68 93.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.374 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.612 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.72 -48.92 79.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.312 0.577 . . . . 0.0 109.874 -179.503 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -64.54 -38.74 92.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 79' ' ' ARG . 70.4 t -63.5 -46.19 95.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.649 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.35 -49.49 83.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.313 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.62 -39.89 88.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.868 0.366 . . . . 0.0 110.788 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -58.36 -50.26 74.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.787 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.92 -43.87 97.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.806 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.507 ' OH ' HD13 ' A' ' 45' ' ' LEU . 4.8 m-85 -62.91 -27.06 69.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.311 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.35 22.64 78.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.8 mt . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.93 0.395 . . . . 0.0 110.612 -179.962 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 80.8 mt . . . . . 0 C--O 1.237 0.407 0 CA-C-O 120.879 0.371 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.5 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 94.9 mt-10 -54.56 -28.68 47.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.476 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.8 mttt -62.37 -48.14 81.1 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.795 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.53 -44.41 78.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.439 . . . . 0.0 112.013 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.683 ' CE2' HD13 ' A' ' 135' ' ' LEU . 10.3 t-105 -56.54 -53.67 54.83 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.795 -178.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.5 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 8.2 m-70 -67.6 -31.8 72.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.49 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.586 ' O ' ' OG ' ' A' ' 127' ' ' SER . 13.8 tptt -57.33 -50.68 72.19 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.052 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.09 -46.84 64.04 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.806 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -50.6 -48.08 57.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.004 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.2 m -85.05 -39.35 18.1 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.586 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 17.0 m -45.75 -30.86 1.76 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.096 -178.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -152.67 -90.17 0.08 OUTLIER Glycine 0 N--CA 1.464 0.541 0 C-N-CA 119.993 -1.099 . . . . 0.0 111.184 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.78 23.3 0.06 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.444 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -67.5 50.48 0.05 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.401 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.476 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.3 m -104.3 118.48 36.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.013 0.435 . . . . 0.0 111.812 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 111.94 -98.04 0.97 Allowed Glycine 0 CA--C 1.53 1.008 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.531 178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.535 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 12.8 pt-20 -73.78 -42.16 61.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.213 0.53 . . . . 0.0 111.149 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.458 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.7 mp0 -59.24 -48.29 82.18 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.258 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.683 HD13 ' CE2' ' A' ' 121' ' ' TRP . 3.0 mt -62.08 -40.48 95.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.127 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.535 ' OD2' ' HA ' ' A' ' 133' ' ' GLU . 0.0 OUTLIER -62.12 -39.31 92.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.075 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -63.1 -43.94 97.08 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 110.02 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.8 mm? -59.95 -42.21 93.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -33.54 76.14 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.69 177.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.589 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 82.0 mmt-85 -58.67 -41.48 86.25 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.67 -40.55 76.34 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.568 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -58.93 -58.45 8.58 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.137 0.494 . . . . 0.0 110.481 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.47 -36.97 77.01 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.049 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.589 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 49.0 m170 -54.17 -42.4 69.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.582 ' O ' HG12 ' A' ' 149' ' ' VAL . 4.6 m-70 -65.98 -36.81 84.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 178.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.85 -45.89 90.99 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.47 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.7 pt-20 -71.42 -47.89 53.05 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.412 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.435 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 49.0 mtmt -63.2 -46.64 86.08 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.178 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.582 HG12 ' O ' ' A' ' 145' ' ' HIS . 6.5 p -62.86 -36.5 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.224 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.696 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -65.33 -40.6 93.88 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.402 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 155' ' ' LEU . 79.2 mm-40 -64.27 -39.87 94.82 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.534 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.445 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 22.1 m-85 -62.54 -49.13 76.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . 0.535 ' OD1' ' HA ' ' A' ' 150' ' ' HIS . 0.9 OUTLIER -74.57 -42.57 58.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.003 0.43 . . . . 0.0 111.004 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 150' ' ' HIS . 70.8 t -61.61 -45.65 98.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.892 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.413 ' CG ' ' O ' ' A' ' 151' ' ' GLU . 77.9 mt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.197 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 . . . . . 0 CA--C 1.52 -0.196 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 3.6 mt -62.15 -46.25 89.82 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.882 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 66.2 mttm -71.73 -40.71 69.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.442 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -68.51 -43.76 76.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.827 -179.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.467 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 22.6 pttt -72.31 -43.81 63.64 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.215 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.812 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.02 -42.9 72.38 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.777 -179.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.526 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -66.03 -37.05 84.9 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 57.7 m -59.37 -42.55 91.91 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.41 ' OD1' ' C ' ' A' ' 198' ' ' ASN . 32.8 t-20 -62.54 -42.53 99.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.768 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -64.93 -34.15 77.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.381 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.05 -46.79 92.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.281 -1.127 . . . . 0.0 110.281 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 204' ' ' LEU . 30.2 mt -62.69 -42.26 99.54 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.376 -0.53 . . . . 0.0 109.946 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -62.88 -36.66 84.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.471 ' O ' ' HD2' ' A' ' 203' ' ' ARG . 15.4 tpt180 -64.23 -41.56 96.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.821 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.507 HD12 HD23 ' A' ' 201' ' ' LEU . 81.9 mt -59.25 -38.52 80.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -65.58 -42.15 92.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.623 ' O ' ' N ' ' A' ' 210' ' ' GLN . 79.1 mtt85 -65.74 -36.74 84.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.087 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.651 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.33 -45.99 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.04 0.448 . . . . 0.0 110.127 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 90.0 p -70.25 -27.25 64.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.539 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -98.06 -14.22 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.623 ' N ' ' O ' ' A' ' 206' ' ' ARG . 53.3 tt0 -137.17 -36.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.775 0.322 . . . . 0.0 110.745 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.651 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.521 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 . . . . . 0 C--O 1.233 0.213 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.631 ' O ' ' O ' ' A' ' 221' ' ' PRO . 3.1 tm-20 -59.19 128.91 85.99 Favored Pre-proline 0 C--N 1.329 -0.325 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.236 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.668 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 76.8 Cg_exo -47.09 -155.9 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.611 2.207 . . . . 0.0 111.772 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.668 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 83.5 mtp180 85.81 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.71 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.618 HG13 ' N ' ' A' ' 224' ' ' ILE . 7.5 p -61.07 -51.71 70.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.618 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.6 OUTLIER -64.35 -32.72 58.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.332 0.586 . . . . 0.0 109.516 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -63.25 -39.35 94.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.477 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.522 ' HA ' HD12 ' A' ' 229' ' ' LEU . 10.7 mt -61.29 -40.89 95.83 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.577 ' CH2' HD23 ' A' ' 308' ' ' LEU . 43.6 m0 -59.61 -40.08 86.33 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.029 -0.668 . . . . 0.0 110.057 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 49.6 m-20 -63.52 -36.94 85.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.654 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.599 ' C ' ' H ' ' A' ' 231' ' ' GLN . 13.0 mt -63.85 -41.07 97.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.311 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -59.2 4.95 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.974 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.714 ' O ' HD21 ' A' ' 240' ' ' LEU . 5.4 pt20 -64.27 -40.96 97.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.839 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 18.8 p -154.03 23.39 0.5 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.522 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -60.87 -47.63 85.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.677 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -176.9 65.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.55 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 235' ' ' LEU . 94.1 mt -133.42 157.11 46.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.083 0.468 . . . . 0.0 110.675 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 22.0 p -78.95 171.23 15.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.49 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -64.55 -45.25 87.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.996 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.91 -45.61 92.99 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.25 0.548 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -64.64 -33.79 76.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.696 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.714 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -63.04 -42.8 99.83 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.508 -179.94 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . 0.582 ' OE2' ' NH2' ' A' ' 244' ' ' ARG . 53.1 tp10 -63.73 -47.72 79.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.197 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.95 -42.75 99.47 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.359 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.587 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.1 OUTLIER -69.87 -30.27 67.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.447 179.406 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . 0.582 ' NH2' ' OE2' ' A' ' 241' ' ' GLU . 57.8 ttp180 -65.03 -58.61 5.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.089 0.471 . . . . 0.0 110.691 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -66.32 -39.38 89.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.088 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -57.74 -55.88 29.09 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.304 0.574 . . . . 0.0 110.495 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 247' ' ' LEU . 3.8 mm? -63.77 -33.2 75.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.386 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.641 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.8 tttt -58.75 -42.74 89.57 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.28 0.562 . . . . 0.0 110.272 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . 0.407 ' O ' ' HD3' ' A' ' 253' ' ' LYS . 6.4 m-70 -68.89 -43.67 74.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.241 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -61.27 -50.16 74.16 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.433 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.6 pp20? -60.24 -37.13 79.41 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.7 81.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.548 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . 0.407 ' HD3' ' O ' ' A' ' 249' ' ' HIS . 13.9 mptt -63.55 -48.64 76.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.36 -38.99 83.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.058 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -59.44 -54.7 43.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.291 0.567 . . . . 0.0 110.434 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -63.43 -40.6 97.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.915 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . 0.485 ' NE2' ' O ' ' A' ' 297' ' ' THR . 28.4 t-80 -54.28 -47.2 72.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.12 0.486 . . . . 0.0 109.967 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . 0.4 ' O ' ' HB2' ' A' ' 261' ' ' GLN . 60.4 t-20 -61.64 -41.07 96.98 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.174 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -56.34 -45.5 80.36 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 121.098 0.475 . . . . 0.0 109.947 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -63.79 -34.91 78.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.049 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.467 ' HG3' ' O ' ' A' ' 257' ' ' HIS . 26.6 mt-30 -58.57 -47.59 83.75 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -61.58 -45.87 92.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.103 0.478 . . . . 0.0 109.754 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -64.85 -33.07 75.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.006 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 47.2 tp -62.36 -43.78 98.01 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.92 0.391 . . . . 0.0 110.268 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -65.91 -46.01 79.84 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.208 0.527 . . . . 0.0 110.444 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.18 -43.63 98.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.311 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.99 86.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.135 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.69 -45.55 93.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -60.08 -48.99 79.43 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.217 0.532 . . . . 0.0 110.65 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -62.15 -39.2 91.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.56 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.635 ' O ' HD23 ' A' ' 271' ' ' LEU . 4.8 tt -60.49 -44.26 96.14 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.965 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 63.0 ttm-85 -60.2 -43.12 96.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.157 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -66.48 -39.84 89.0 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.651 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.35 84.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 271' ' ' LEU . 96.1 mt-10 -49.64 -19.18 0.55 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.848 0.356 . . . . 0.0 110.396 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . 0.754 ' O ' ' N ' ' A' ' 278' ' ' GLY . 58.6 m -82.81 -75.89 0.29 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.814 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.506 ' C ' ' O ' ' A' ' 276' ' ' SER . 44.1 t 24.29 -77.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 O-C-N 123.686 0.616 . . . . 0.0 110.831 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.754 ' N ' ' O ' ' A' ' 276' ' ' SER . . . 161.17 -77.67 0.17 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.287 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -86.55 123.05 31.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.883 0.373 . . . . 0.0 110.474 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -67.64 144.1 43.24 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -174.92 -46.42 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -96.1 -6.09 39.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.723 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 67.0 t -62.22 -46.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.512 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.39 -46.19 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.071 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.38 -45.41 94.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.5 t -62.11 -42.82 99.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.635 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -63.22 -40.94 98.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.79 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -60.71 -54.31 46.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.364 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.63 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.8 mmtm -65.09 -33.81 76.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.158 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -57.92 -49.01 78.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.271 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -70.07 -38.22 75.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.747 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.63 HD23 ' HD3' ' A' ' 289' ' ' LYS . 2.7 tp -61.62 -50.24 73.37 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.254 -0.579 . . . . 0.0 110.175 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.55 -41.97 98.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.008 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -62.23 -42.46 99.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.19 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -60.93 -47.77 89.59 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 20.3 tpp85 -61.9 -37.34 84.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.437 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.485 ' O ' ' NE2' ' A' ' 257' ' ' HIS . 3.6 m -59.64 -52.24 66.37 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.399 0.618 . . . . 0.0 110.189 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.14 -39.26 92.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -58.23 -45.64 87.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.294 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -44.11 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.132 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -54.96 -44.29 82.62 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . 0.416 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 43.5 t80 -62.49 -43.37 98.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.129 0.49 . . . . 0.0 110.665 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . 0.627 HG22 ' ND1' ' A' ' 307' ' ' HIS . 17.9 m -59.08 -44.76 91.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.578 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.06 -41.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.202 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -56.52 -57.09 13.83 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-O 121.44 0.638 . . . . 0.0 111.075 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . 0.416 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 4.7 mtpt -62.41 -39.94 94.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.723 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.627 ' ND1' HG22 ' A' ' 303' ' ' THR . 4.6 m80 -64.24 -35.7 81.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.106 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.577 HD23 ' CH2' ' A' ' 227' ' ' TRP . 15.4 mt -61.81 -43.93 97.86 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.397 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -67.32 -45.73 75.59 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.998 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.54 -49.67 75.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.963 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.468 ' HA ' HD23 ' A' ' 311' ' ' LEU . 21.9 mt -63.85 -40.63 97.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.856 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 69.4 m -57.7 -43.8 85.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.358 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.49 -43.38 86.94 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 317' ' ' ARG . 7.0 mpt_? -63.66 -45.64 89.22 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.773 0.321 . . . . 0.0 111.058 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -73.17 -23.35 19.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.126 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 38.4 t -59.18 -43.71 92.18 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 314' ' ' ARG . 10.8 tpp180 . . . . . 0 C--N 1.326 -0.422 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.802 0.334 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -63.74 -39.23 93.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.816 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 93.4 mmm -125.31 153.5 43.18 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.056 0.455 . . . . 0.0 110.875 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -60.75 -37.42 81.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.572 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.6 tttp -58.06 -47.16 83.99 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.261 0.553 . . . . 0.0 110.615 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.05 -39.78 93.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.359 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -64.06 -38.66 91.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.11 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.3 -46.37 88.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.433 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 28' ' ' LEU . 97.0 mt -61.7 -43.19 99.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.094 0.473 . . . . 0.0 109.87 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.597 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 52.6 t-105 -61.62 -43.39 98.94 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.214 0.531 . . . . 0.0 110.233 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -57.66 -42.11 82.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.029 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.58 -41.63 97.7 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.159 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.62 87.46 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.124 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.597 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -62.89 -36.99 85.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.055 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -60.99 -43.14 99.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.337 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -63.56 -39.67 95.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.384 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.81 106.94 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -130.42 154.82 81.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.795 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -37.96 155.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.776 2.317 . . . . 0.0 112.055 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.64 -39.87 11.18 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.546 2.164 . . . . 0.0 112.248 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.28 -48.68 84.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.999 0.428 . . . . 0.0 110.534 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -68.29 -39.54 82.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.711 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -62.9 -44.09 97.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.526 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.65 94.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.274 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -66.87 -46.59 74.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.648 HD12 ' OH ' ' A' ' 88' ' ' TYR . 5.2 tt -63.47 -45.78 89.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.547 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -58.39 -43.34 88.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.107 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 51' ' ' ILE . . . -63.14 -41.71 99.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.642 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -56.55 -51.64 67.81 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.917 0.389 . . . . 0.0 110.734 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.84 -38.57 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.372 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -57.79 -45.07 86.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.201 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 47' ' ' ALA . 2.2 mt -63.5 -42.67 97.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.509 ' NE2' HD22 ' A' ' 80' ' ' ASN . 29.5 mm-40 -51.67 -46.19 63.71 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.673 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -64.62 -38.7 91.89 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.908 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -61.52 -44.59 96.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.96 0.409 . . . . 0.0 110.406 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -62.3 -41.57 98.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.377 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -57.3 -49.55 75.73 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.749 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.09 -41.95 93.57 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.967 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.641 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.601 ' HA ' HD21 ' A' ' 62' ' ' LEU . 53.8 t90 -59.1 -41.98 89.41 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.096 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -63.6 -45.16 91.59 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -57.57 -51.57 68.94 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.73 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 59' ' ' TRP . 2.0 pp -65.34 -39.15 92.03 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.808 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 62' ' ' LEU . 29.1 tptp -58.25 -42.28 86.05 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 38.3 tp . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.637 178.65 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.614 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -62.42 -31.44 72.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.696 0.284 . . . . 0.0 110.275 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.89 -52.64 64.54 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.047 0.451 . . . . 0.0 110.271 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -61.14 -42.17 98.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.08 179.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.01 90.58 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.239 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -61.19 -43.14 99.35 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.483 HD23 HE22 ' A' ' 52' ' ' GLN . 90.0 mt -62.36 -44.05 97.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.39 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.53 -46.9 91.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 120.97 0.414 . . . . 0.0 110.283 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.715 ' O ' HG23 ' A' ' 83' ' ' VAL . 90.1 mtt-85 -62.88 -42.49 99.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.229 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.509 HD22 ' NE2' ' A' ' 52' ' ' GLN . 33.3 t30 -64.01 -39.67 94.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.449 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.71 -48.55 81.21 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.632 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.403 ' HA ' HD22 ' A' ' 82' ' ' ASN . 10.3 m120 -64.86 -39.32 93.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.586 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 79' ' ' ARG . 79.4 t -62.84 -45.62 98.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.343 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -61.38 -48.61 88.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.583 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.26 -41.61 94.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.893 0.377 . . . . 0.0 110.542 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.52 89.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.721 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -63.41 -47.95 79.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.596 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.648 ' OH ' HD12 ' A' ' 45' ' ' LEU . 17.9 m-85 -68.87 -30.9 69.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.505 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.48 25.26 36.58 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt . . . . . 0 N--CA 1.462 0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.529 179.664 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 53.7 mt . . . . . 0 C--O 1.237 0.424 0 CA-C-O 121.186 0.517 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.672 ' OE1' ' NE2' ' A' ' 122' ' ' HIS . 27.0 mm-40 -56.04 -25.08 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.194 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 53.4 mttp -61.27 -49.06 78.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.28 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.584 HD13 ' O ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -69.38 -45.09 70.15 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.998 0.428 . . . . 0.0 111.622 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.652 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.6 t-105 -57.72 -49.72 75.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.324 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.672 ' NE2' ' OE1' ' A' ' 118' ' ' GLU . 12.6 m-70 -66.27 -35.6 80.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.385 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 127' ' ' SER . 14.0 tptt -55.83 -50.89 69.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.819 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.519 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.46 -47.38 64.16 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.105 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -53.98 -51.85 62.59 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.789 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -75.02 -43.91 50.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.005 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.519 ' OG ' ' HA ' ' A' ' 124' ' ' ALA . 22.4 p -46.6 -28.16 1.36 Allowed 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -178.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.49 -95.42 0.11 Allowed Glycine 0 CA--C 1.519 0.314 0 C-N-CA 119.996 -1.097 . . . . 0.0 111.525 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.04 32.23 0.08 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.563 ' CG ' ' OE1' ' A' ' 134' ' ' GLU . 3.9 m-85 -66.81 49.85 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.469 -179.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.7 m -104.11 124.11 48.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.008 0.433 . . . . 0.0 111.995 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 109.2 -97.49 1.06 Allowed Glycine 0 CA--C 1.53 0.976 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.384 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 134' ' ' GLU . 15.7 pt-20 -78.62 -43.31 26.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.858 0.361 . . . . 0.0 111.329 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.563 ' OE1' ' CG ' ' A' ' 130' ' ' PHE . 56.7 mt-10 -60.58 -51.35 69.8 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.209 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.652 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.4 mt -63.27 -42.86 99.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.502 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -61.17 -42.0 97.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.624 ' HA ' ' HE ' ' A' ' 140' ' ' ARG . 97.1 mttt -61.88 -41.1 97.48 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.167 0.508 . . . . 0.0 110.002 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.66 -41.73 91.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.445 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -66.19 -34.16 77.4 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 177.429 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.624 ' HE ' ' HA ' ' A' ' 137' ' ' LYS . 53.9 mtm180 -57.56 -45.99 84.47 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.842 -1.143 . . . . 0.0 108.202 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -71.9 -38.1 70.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.938 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -58.88 -58.25 9.45 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.786 -179.289 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.65 -40.73 95.96 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.066 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.581 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 47.6 m170 -56.74 -44.34 81.58 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.726 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 149' ' ' VAL . 3.1 m-70 -60.67 -42.39 96.98 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.606 179.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -60.54 -43.48 97.14 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.744 -0.383 . . . . 0.0 111.386 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 151' ' ' GLU . 98.6 mt-10 -65.98 -55.78 15.02 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.703 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.23 -42.68 99.26 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.56 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 145' ' ' HIS . 43.9 t -61.56 -45.42 98.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.144 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.659 ' C ' ' CD2' ' A' ' 150' ' ' HIS . 1.1 p-80 -65.5 -36.27 83.35 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.931 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.602 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 94.2 mt-10 -59.39 -46.23 89.26 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.997 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -61.72 -45.18 95.06 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.684 -0.406 . . . . 0.0 109.955 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.65 -39.29 91.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.15 -47.84 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 62.6 mt . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.51 179.147 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 . . . . . 0 CA--C 1.523 -0.08 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 7.6 mt -61.97 -47.54 84.38 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.444 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.493 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.6 mtmt -70.22 -37.73 75.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.939 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -67.67 -51.02 54.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.488 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 18.4 pttt -67.13 -42.9 83.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.313 -179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.712 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -70.06 -40.49 75.05 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.632 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.5 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 25.3 mmt180 -64.06 -39.5 94.22 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.244 -0.583 . . . . 0.0 109.643 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 78.4 p -62.68 -44.3 96.6 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.456 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.97 -44.4 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.91 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -63.37 -41.56 98.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.826 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 70.6 mt-30 -66.03 -29.54 69.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.123 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.59 -47.22 63.37 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.462 ' HA ' HD23 ' A' ' 201' ' ' LEU . 32.8 mt -64.44 -42.89 95.72 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.873 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.826 ' OD1' ' O ' ' A' ' 199' ' ' GLN . 0.4 OUTLIER -65.85 -35.38 80.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.0 tmt_? -63.42 -42.93 98.74 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.19 -40.57 96.52 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -62.65 -42.66 99.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.867 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.767 ' O ' ' N ' ' A' ' 210' ' ' GLN . 67.9 mtp180 -65.23 -38.34 90.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.064 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 203' ' ' ARG . 52.9 t -64.07 -47.64 89.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.906 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.8 m -71.16 -29.5 65.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.496 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -93.93 -42.27 9.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.372 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.767 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.7 tt0 -105.04 -35.83 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.11 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.459 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.487 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 219' ' ' GLU . 82.3 tt0 . . . . . 0 CA--C 1.528 0.107 0 CA-C-O 120.708 0.289 . . . . 0.0 110.49 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -56.06 157.47 8.52 Favored Pre-proline 0 C--O 1.232 0.178 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.912 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.484 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 35.3 Cg_exo -56.88 -171.36 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.373 2.049 . . . . 0.0 111.863 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.484 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 0.2 OUTLIER 82.82 -85.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.87 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.998 HG13 ' H ' ' A' ' 224' ' ' ILE . 4.7 p -62.46 -69.22 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.727 0 CA-C-O 121.321 0.581 . . . . 0.0 111.838 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.998 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.5 OUTLIER -56.57 -34.33 41.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . 0.425 ' HB2' ' N ' ' A' ' 222' ' ' ARG . 6.4 m-20 -64.42 -37.0 86.0 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.089 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.45 -42.81 96.9 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.491 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 42.7 m0 -61.73 -38.75 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.15 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -61.54 -38.28 86.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 231' ' ' GLN . 92.3 mt -64.7 -42.06 95.55 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.482 0.658 . . . . 0.0 110.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.452 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -45.38 -19.23 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.902 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.447 ' N ' ' O ' ' A' ' 229' ' ' LEU . 8.9 tt0 -75.13 -69.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.628 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.439 ' O ' ' O ' ' A' ' 233' ' ' ALA . 5.0 m -73.3 -19.05 61.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.562 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -44.04 -96.0 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.668 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -168.87 93.7 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.703 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.452 HD12 ' O ' ' A' ' 230' ' ' ALA . 85.8 mt -141.24 163.83 31.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.649 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.2 p -78.37 166.15 22.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.64 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . 0.421 ' OD1' ' C ' ' A' ' 237' ' ' ASP . 60.0 t0 -66.07 -48.74 69.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.154 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -62.13 -46.74 87.66 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.123 0.487 . . . . 0.0 110.451 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -62.19 -40.02 94.65 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.292 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 240' ' ' LEU . 17.3 mt -65.54 -34.2 77.7 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.772 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -63.67 -51.87 63.18 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.084 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -65.36 -41.8 93.43 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.344 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.449 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.7 OUTLIER -66.25 -43.06 87.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.403 179.318 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -58.94 -47.55 84.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.195 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -68.18 -42.6 79.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.703 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -57.03 -51.4 69.4 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.13 0.49 . . . . 0.0 110.43 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 2.3 mm? -63.62 -38.92 92.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.529 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 38.4 ttpt -54.82 -45.04 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -66.14 -40.1 90.34 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.552 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . 0.456 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 23.5 t80 -58.07 -50.15 74.44 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.317 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 7.7 pt-20 -62.81 -36.67 83.92 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.86 -38.52 86.51 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.563 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.81 -46.57 87.36 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.243 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -66.08 -39.82 85.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.172 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.19 -46.07 92.0 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.162 0.506 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -61.66 -44.84 96.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.966 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . 0.483 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -54.47 -43.02 71.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . 0.483 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 47.2 t30 -60.8 -41.25 95.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.305 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -59.99 -48.29 82.32 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.521 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -62.32 -36.22 81.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.538 ' OE1' HG21 ' A' ' 297' ' ' THR . 13.1 mm100 -60.58 -42.63 97.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.12 -47.56 85.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.124 0.487 . . . . 0.0 109.86 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -64.06 -35.67 81.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.922 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 62.8 tp -62.04 -41.81 98.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.954 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -63.85 -46.23 85.94 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 110.475 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 67.2 mt -62.74 -43.41 98.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.97 82.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.025 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -61.56 -46.2 90.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -58.09 -48.67 79.45 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.098 0.475 . . . . 0.0 110.119 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -62.46 -35.8 80.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.378 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.689 ' O ' HD23 ' A' ' 271' ' ' LEU . 3.1 tt -59.07 -44.68 91.87 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -63.84 -41.25 97.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.276 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -66.04 -45.04 82.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.659 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.611 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.32 -34.88 77.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.886 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . 0.544 ' OE2' HG13 ' A' ' 283' ' ' VAL . 41.6 mm-40 -57.67 -31.42 66.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.893 0.377 . . . . 0.0 110.342 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 5.4 m -87.15 6.79 31.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.926 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 274' ' ' ALA . 12.3 p -60.38 -45.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.759 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.597 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 160.25 -113.0 0.55 Allowed Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -61.32 -47.86 83.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.716 0.294 . . . . 0.0 110.654 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 135.14 -102.77 0.44 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 65.73 -60.43 0.28 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.931 0.396 . . . . 0.0 110.368 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -67.1 -17.33 64.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.281 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . 0.544 HG13 ' OE2' ' A' ' 275' ' ' GLU . 81.3 t -63.81 -43.3 97.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.803 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . 0.46 ' O ' ' HG2' ' A' ' 287' ' ' ARG . 5.8 t -59.22 -45.72 90.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.156 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -69.63 -43.85 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 4.4 p -61.27 -48.6 80.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.932 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 284' ' ' SER . 34.9 ptt180 -65.58 -34.88 79.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 110.467 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.24 -65.1 0.7 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.092 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.486 ' HD3' HD23 ' A' ' 292' ' ' LEU . 25.6 mmtt -63.04 -39.21 94.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.824 -0.75 . . . . 0.0 109.961 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 286' ' ' SER . 39.7 t-80 -43.94 -55.78 4.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.076 0.465 . . . . 0.0 110.051 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.24 79.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.883 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.486 HD23 ' HD3' ' A' ' 289' ' ' LYS . 18.1 tp -59.78 -53.21 60.63 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.838 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.21 -42.26 96.68 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.253 0.549 . . . . 0.0 110.31 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.0 tt0 -61.93 -37.68 85.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.786 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.48 -43.67 97.83 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -59.45 -44.44 92.97 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.356 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.538 HG21 ' OE1' ' A' ' 261' ' ' GLN . 44.8 p -59.17 -44.61 92.16 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.654 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -62.36 -45.32 93.7 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.638 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.79 -38.88 89.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.202 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.26 96.71 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.35 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.69 -42.71 98.04 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -61.3 -44.23 97.56 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.995 0.426 . . . . 0.0 110.573 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . 0.578 HG22 ' ND1' ' A' ' 307' ' ' HIS . 19.8 m -60.44 -43.92 96.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.656 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.83 -43.38 91.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -57.8 -51.78 68.19 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.824 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -63.61 -40.92 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.462 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.578 ' ND1' HG22 ' A' ' 303' ' ' THR . 5.8 m80 -63.62 -36.42 83.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.929 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.528 ' CD2' HG21 ' A' ' 223' ' ' VAL . 7.8 mt -62.02 -44.38 96.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.614 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.4 -47.81 69.22 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.943 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.46 -48.14 82.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 311' ' ' LEU . 25.5 mt -63.2 -39.45 94.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.576 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.2 t -58.93 -44.42 91.37 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.15 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.63 -41.75 89.1 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 317' ' ' ARG . 94.3 mtt-85 -64.41 -45.13 88.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.917 0.389 . . . . 0.0 111.233 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.9 mm -72.52 -18.03 18.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.712 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 71.8 p -50.49 -34.82 26.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 314' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 178.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.802 0.334 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.439 ' HE ' ' HG3' ' A' ' 53' ' ' GLU . 52.5 ptt85 -91.29 -6.4 53.22 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.548 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.408 ' SD ' ' NZ ' ' A' ' 24' ' ' LYS . 3.6 mmt -137.45 144.46 42.33 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.767 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.692 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 46.6 tp10 -66.13 -53.12 41.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.465 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.408 ' NZ ' ' SD ' ' A' ' 22' ' ' MET . 8.0 pttm -51.58 -43.74 62.55 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.239 0.542 . . . . 0.0 110.322 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.2 tp -61.62 -42.95 99.61 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.386 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.723 ' OD1' ' N ' ' A' ' 27' ' ' GLN . 1.5 p-10 -65.25 -25.35 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.234 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.723 ' N ' ' OD1' ' A' ' 26' ' ' ASN . 92.2 mt-30 -69.47 -45.62 68.58 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.921 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.3 mm? -61.83 -41.68 98.09 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.387 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.495 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 41.2 t-105 -61.82 -46.04 91.22 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.342 0.592 . . . . 0.0 110.399 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -57.86 -41.31 82.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.182 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -60.91 -41.76 96.75 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.183 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.93 86.85 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.205 0.526 . . . . 0.0 110.415 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.495 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 75.0 mt-30 -58.29 -39.12 78.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.241 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -62.78 -41.54 99.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.511 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.13 -34.84 77.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.262 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.57 107.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.869 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 37' ' ' LEU . 86.2 mt -129.05 154.54 80.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.572 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 74.8 Cg_exo -41.63 153.32 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.529 2.153 . . . . 0.0 112.206 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.6 Cg_exo -57.2 -47.31 23.14 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.724 2.283 . . . . 0.0 112.327 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 69.5 t -64.29 -47.19 90.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.667 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -63.2 -41.87 99.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.389 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.0 tt -62.3 -43.01 99.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.629 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.5 -41.2 96.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.453 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -69.92 -42.54 73.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.496 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.97 -48.88 78.37 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -61.84 -40.54 95.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.21 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.43 -47.0 87.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.6 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.971 ' O ' HG22 ' A' ' 51' ' ' ILE . 50.3 t0 -59.43 -49.84 76.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.119 0.485 . . . . 0.0 110.293 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.63 -41.4 99.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.1 0.476 . . . . 0.0 110.441 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.26 -47.45 85.95 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.35 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.971 HG22 ' O ' ' A' ' 48' ' ' ASP . 16.9 tt -59.51 -36.82 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.403 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 52.2 tt0 -60.96 -42.42 98.26 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.439 ' HG3' ' HE ' ' A' ' 21' ' ' ARG . 76.7 tt0 -61.07 -40.29 93.09 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.85 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -62.92 -44.29 96.48 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.728 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -60.98 -41.28 96.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.485 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -57.78 -48.49 79.54 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.005 0.431 . . . . 0.0 110.186 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.3 tp -59.99 -41.43 92.02 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.11 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.13 93.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.299 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.6 t90 -58.34 -44.97 88.95 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.067 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.58 -46.22 91.04 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.54 -41.87 86.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.181 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.12 -40.04 96.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.962 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.72 -42.98 84.91 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 39.4 mt . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.103 179.123 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -58.95 -36.18 74.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.359 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 73' ' ' LYS . 13.6 mptt -56.65 -68.58 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.099 0.476 . . . . 0.0 109.958 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -46.04 -38.95 8.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.16 94.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.559 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -63.64 -38.96 93.09 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.448 HD12 ' N ' ' A' ' 77' ' ' LEU . 9.3 mp -64.32 -45.07 89.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.11 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.07 -45.91 95.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.177 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.741 ' O ' HG23 ' A' ' 83' ' ' VAL . 77.2 ttt-85 -59.57 -43.85 93.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.112 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -62.63 -39.74 94.78 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.112 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.666 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.22 -50.92 71.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.285 0.564 . . . . 0.0 110.239 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.409 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 30.0 t-20 -64.97 -37.32 87.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.699 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 79' ' ' ARG . 73.2 t -63.27 -45.88 97.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.393 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.16 -49.98 82.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.507 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.449 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 3.6 mm? -66.55 -42.02 87.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.019 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.24 94.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.06 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -62.38 -47.9 82.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.855 -179.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.08 -26.6 68.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.265 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.19 8.12 78.95 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.969 -0.853 . . . . 0.0 110.969 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 90' ' ' LEU . 56.5 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-O 120.827 0.346 . . . . 0.0 110.557 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 C--O 1.239 0.501 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.629 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 94.7 mt-10 -62.4 -28.69 69.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.505 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 11.2 mmmt -60.96 -46.62 90.0 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.574 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 120' ' ' LEU . 81.3 mt -69.35 -46.79 66.17 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 120.948 0.404 . . . . 0.0 111.796 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.45 ' CE3' HD22 ' A' ' 135' ' ' LEU . 11.9 t-105 -59.25 -47.08 86.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.605 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.629 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.1 m-70 -69.73 -34.22 73.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.615 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.541 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 10.6 tptt -57.92 -52.0 67.32 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.178 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.818 ' O ' ' O ' ' A' ' 128' ' ' GLY . . . -73.61 -46.7 45.44 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.523 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.573 ' HB2' HD11 ' A' ' 135' ' ' LEU . 64.3 tttm -50.09 -39.79 43.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.669 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.463 ' C ' ' H ' ' A' ' 128' ' ' GLY . 20.8 m -97.69 -66.67 0.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.708 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 m -55.74 -7.0 0.24 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.419 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 1.153 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -160.25 98.38 0.17 Allowed Glycine 0 C--O 1.226 -0.373 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -41.98 44.78 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.355 0.598 . . . . 0.0 109.928 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 1.153 ' N ' ' O ' ' A' ' 128' ' ' GLY . 3.4 m-30 -81.05 32.09 0.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.385 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.647 ' HA ' HD12 ' A' ' 135' ' ' LEU . 6.2 m -85.13 128.45 34.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.008 0.432 . . . . 0.0 111.533 -179.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.45 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . 111.3 -98.17 1.01 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.356 177.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 74.7 mm-40 -79.17 -43.85 23.11 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.991 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.463 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.1 mp0 -62.44 -50.49 71.28 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.076 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.647 HD12 ' HA ' ' A' ' 131' ' ' SER . 2.7 mt -61.09 -42.09 97.87 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.363 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.45 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 96.2 m-20 -63.3 -37.71 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.936 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 23.1 mmtp -62.26 -44.25 96.97 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-O 121.266 0.555 . . . . 0.0 109.991 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.2 mm? -60.21 -43.47 95.93 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.247 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.481 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -65.21 -36.64 84.79 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.058 176.459 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.607 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 86.5 mtt180 -53.53 -43.79 68.66 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -70.12 -38.37 75.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.76 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.481 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.1 m-85 -59.35 -58.54 8.16 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.59 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 67.0 mt -60.79 -38.84 86.7 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.022 -0.671 . . . . 0.0 110.26 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.607 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 61.3 m170 -53.15 -43.98 67.45 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.096 -0.642 . . . . 0.0 109.706 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.461 ' ND1' HG23 ' A' ' 197' ' ' ILE . 3.3 m-70 -64.09 -39.52 94.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.658 178.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -61.75 -44.46 96.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.33 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -68.26 -51.2 47.79 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.698 0.285 . . . . 0.0 111.516 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -61.58 -43.42 98.9 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.954 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 26.1 t -62.49 -43.36 98.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.021 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.771 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -63.21 -38.51 91.45 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.67 -47.68 84.26 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.279 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.46 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 23.0 m-85 -65.8 -46.62 77.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.551 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.82 79.89 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.504 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.771 HG23 ' O ' ' A' ' 150' ' ' HIS . 77.9 t -63.31 -45.48 98.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.031 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.2 mt . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.519 179.767 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 . . . . . 0 C--O 1.232 0.168 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.626 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 7.1 mt -62.47 -43.35 99.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.866 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.6 mttm -70.67 -32.72 70.08 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.602 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.4 tt0 -68.42 -45.89 71.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.183 -178.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.626 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 7.8 ptmt -73.47 -44.61 57.62 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.498 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.78 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -65.18 -41.72 94.34 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.887 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.529 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -68.32 -36.58 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.819 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.412 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 63.8 m -61.45 -40.93 96.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.461 HG23 ' ND1' ' A' ' 145' ' ' HIS . 96.6 mt -63.53 -43.95 98.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.518 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.8 -42.25 97.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -63.97 -37.39 87.24 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.568 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.98 -43.15 99.79 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 17.5 mt -64.06 -42.26 97.06 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.201 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.69 -38.38 90.19 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.778 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.665 ' O ' HG12 ' A' ' 207' ' ' VAL . 31.7 mt -61.0 -39.01 88.07 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.413 179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 83.3 mtt-85 -64.12 -41.62 97.16 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.19 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.6 mtp180 -64.82 -42.85 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.769 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.665 HG12 ' O ' ' A' ' 204' ' ' LEU . 0.3 OUTLIER -63.77 -37.42 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.44 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . 0.417 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 25.4 m -75.96 -26.92 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.575 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -98.29 -15.08 19.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.033 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.526 ' N ' ' O ' ' A' ' 206' ' ' ARG . 52.4 mt-30 -129.53 -39.07 1.5 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.696 -179.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.549 0 N-CA-C 111.392 -0.683 . . . . 0.0 111.392 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 . . . . . 0 N--CA 1.441 -0.889 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -145.18 154.5 54.14 Favored Pre-proline 0 C--N 1.326 -0.431 0 C-N-CA 119.165 -1.014 . . . . 0.0 110.479 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.73 13.99 0.88 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.663 2.242 . . . . 0.0 112.147 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -124.58 -40.98 2.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.02 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 1.068 HG13 ' H ' ' A' ' 224' ' ' ILE . 5.8 p -61.47 -78.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.246 0.916 0 CA-C-O 121.42 0.629 . . . . 0.0 110.869 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 1.068 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.1 mp -58.05 -25.54 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.45 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -63.24 -46.91 84.71 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.205 0.526 . . . . 0.0 109.844 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.457 HD23 HD12 ' A' ' 229' ' ' LEU . 24.5 mt -61.48 -40.99 96.53 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.677 179.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.0 m0 -61.39 -35.58 77.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.953 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -64.86 -37.28 87.1 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.708 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.6 mt -63.41 -41.27 98.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.968 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -60.03 20.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.0 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.708 ' H ' ' C ' ' A' ' 229' ' ' LEU . 13.8 tt0 -94.26 -44.82 7.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.668 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.2 p -121.03 -0.69 9.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.622 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.33 -103.52 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.587 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -141.53 95.39 2.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.505 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 3.8 mp -137.84 160.26 39.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.95 0.405 . . . . 0.0 110.562 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 33.9 p -85.44 -157.41 0.32 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.586 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . 0.47 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 27.4 p-10 -96.34 -59.33 1.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.629 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . 0.47 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 54.4 mtmt -62.25 -44.03 97.48 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 110.697 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -60.33 -32.0 70.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.163 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.632 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.2 OUTLIER -63.94 -43.24 96.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.189 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -63.73 -49.5 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.16 -38.23 85.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.042 0.449 . . . . 0.0 110.092 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.578 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.3 OUTLIER -68.21 -41.74 80.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.01 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -58.6 -52.25 66.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.96 0.41 . . . . 0.0 110.197 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.7 -42.27 95.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.577 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -56.5 -48.12 77.86 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.416 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 243' ' ' PHE . 1.4 mm? -63.49 -38.38 90.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.484 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.797 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 78.7 tttt -56.56 -44.81 81.29 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.347 0.594 . . . . 0.0 110.296 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -67.62 -38.57 84.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.488 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.35 -49.24 78.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.797 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.1 OUTLIER -60.5 -39.89 89.4 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.237 0.542 . . . . 0.0 109.873 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . 0.521 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.08 -36.86 84.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.266 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -62.37 -49.88 73.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.144 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.485 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.9 tt -61.91 -36.0 71.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.362 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -62.98 -45.9 90.26 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.166 0.508 . . . . 0.0 110.349 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -63.16 -44.77 94.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.536 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . 0.793 ' HB2' HD23 ' A' ' 300' ' ' LEU . 2.3 t-80 -55.96 -43.49 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.163 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -62.07 -40.97 97.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.19 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . 0.519 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 80.2 t60 -58.76 -48.21 82.02 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.413 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -63.52 -33.44 75.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.544 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.503 HE21 ' HB ' ' A' ' 297' ' ' THR . 64.3 mm-40 -61.63 -47.71 84.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.214 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -61.43 -46.25 90.87 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.051 0.453 . . . . 0.0 110.061 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . 0.519 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.6 mp0 -64.7 -35.18 80.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.242 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.82 -42.59 99.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.06 -46.24 85.23 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.467 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.64 -43.37 98.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.346 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -63.26 -36.89 85.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.252 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -61.64 -47.73 84.05 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.332 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -64.54 -43.52 93.7 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.628 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.49 -43.09 99.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.518 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 271' ' ' LEU . 6.1 tt -60.85 -44.38 97.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.322 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.97 -43.9 91.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.281 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -69.07 -47.32 65.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.663 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.841 ' O ' HG22 ' A' ' 277' ' ' VAL . . . -60.43 -24.63 65.34 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.492 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -84.46 -1.74 56.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.476 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 42.2 m -120.06 -3.14 10.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.707 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.841 HG22 ' O ' ' A' ' 274' ' ' ALA . 16.8 m -63.33 -42.66 97.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.499 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.448 ' N ' HG23 ' A' ' 277' ' ' VAL . . . 139.03 -82.9 0.25 Allowed Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.88 139.06 58.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.757 0.313 . . . . 0.0 110.402 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -107.41 116.44 4.92 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -145.49 -45.12 0.21 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.488 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -98.7 0.64 45.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.553 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.97 -48.29 88.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.538 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.5 t -63.36 -46.84 84.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.907 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.6 -41.65 96.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.739 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.0 t -62.47 -44.07 97.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -63.43 -41.61 98.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.498 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -60.34 -52.33 65.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.278 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.534 ' HD3' HD23 ' A' ' 292' ' ' LEU . 18.2 mmtm -65.77 -33.42 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.135 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -56.45 -48.05 77.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.155 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.22 -40.44 71.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.968 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.591 ' O ' HD12 ' A' ' 292' ' ' LEU . 3.5 tp -61.81 -50.67 71.39 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.26 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 23.9 tp -63.63 -41.48 98.25 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.4 tt0 -62.73 -37.72 87.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.022 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . 0.463 ' O ' ' HG3' ' A' ' 299' ' ' GLU . . . -64.01 -47.03 89.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . 0.461 HH12 HD22 ' A' ' 300' ' ' LEU . 15.4 tpt85 -57.82 -44.16 86.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.474 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.503 ' HB ' HE21 ' A' ' 261' ' ' GLN . 12.2 p -60.36 -48.1 83.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.346 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 295' ' ' GLY . 90.3 mt-10 -57.95 -55.33 36.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.592 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . 0.793 HD23 ' HB2' ' A' ' 257' ' ' HIS . 12.9 tp -61.56 -45.03 95.87 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.465 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -47.43 -47.02 22.88 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.084 -1.206 . . . . 0.0 110.084 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -65.48 -37.15 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.929 0.395 . . . . 0.0 109.967 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 20.0 m -60.47 -47.4 86.29 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . 0.401 HG13 HD13 ' A' ' 308' ' ' LEU . 1.3 t -61.36 -46.13 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.376 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.41 -46.78 88.69 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.044 0.449 . . . . 0.0 110.284 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -58.56 -50.18 74.72 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.424 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.55 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.4 OUTLIER -65.07 -30.34 71.29 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.99 178.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.782 HD11 HG21 ' A' ' 223' ' ' VAL . 1.4 tp -58.53 -46.58 86.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.056 -178.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -76.15 -54.49 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.813 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 310' ' ' ASP . 61.6 t0 -58.96 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.55 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 3.4 tp -61.67 -39.79 92.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.512 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 10.4 t -58.73 -43.56 90.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.665 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.17 -40.12 94.8 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 317' ' ' ARG . 77.5 mtp180 -61.7 -43.46 98.82 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-O 120.693 0.282 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.7 -42.48 95.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.792 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 83.6 p -49.67 -39.77 37.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.224 0.535 . . . . 0.0 109.649 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 314' ' ' ARG . 22.4 tpp85 . . . . . 0 CA--C 1.513 -0.465 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.643 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 C--O 1.235 0.3 0 CA-C-O 120.669 0.271 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -88.68 2.39 53.37 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.723 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.436 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 3.7 mmt -143.11 140.06 30.71 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.375 0.607 . . . . 0.0 110.824 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.22 -36.26 81.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.306 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -56.5 -47.08 80.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.131 0.491 . . . . 0.0 110.542 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 25' ' ' LEU . 99.3 mt -61.47 -40.17 93.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.856 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.436 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.5 m-80 -63.94 -37.4 87.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.169 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -60.39 -48.66 80.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.297 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.429 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 4.0 mm? -61.23 -42.38 98.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.205 179.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.509 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 34.1 t-105 -62.18 -44.53 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.229 0.538 . . . . 0.0 110.387 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -57.03 -44.96 83.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.246 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.6 -42.82 97.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.424 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.27 -41.85 80.5 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.218 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.509 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.2 mt-30 -64.7 -37.67 88.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.192 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -60.09 -43.62 95.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.449 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.39 -39.46 92.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.596 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.45 110.72 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.849 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.47 HD22 ' HE ' ' A' ' 41' ' ' ARG . 13.8 mt -131.46 154.16 81.81 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.62 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -43.28 154.32 0.18 Allowed 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.618 2.212 . . . . 0.0 112.193 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.51 -42.04 69.74 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.582 2.188 . . . . 0.0 112.191 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.15 -49.71 82.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.551 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.47 ' HE ' HD22 ' A' ' 37' ' ' LEU . 78.6 mtp85 -66.47 -41.35 89.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 tp -64.26 -40.18 95.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.434 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 41' ' ' ARG . 18.1 pt-20 -65.15 -38.86 91.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.466 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.37 -50.11 72.85 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.398 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -61.2 -39.97 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.444 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.94 92.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.425 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -60.56 -50.17 74.61 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.366 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.04 -39.3 94.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.383 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -56.55 -46.91 80.43 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.215 0.531 . . . . 0.0 110.142 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.7 mt -62.31 -42.73 96.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.761 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -51.51 -42.81 61.98 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -64.42 -41.26 96.7 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -61.4 -44.45 97.13 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.629 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -61.22 -41.62 97.17 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.373 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -54.75 -46.74 74.37 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.149 0.499 . . . . 0.0 110.062 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 23.8 mt -61.72 -41.4 97.57 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.334 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.94 -46.33 88.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.647 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.5 t90 -58.99 -39.9 83.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.342 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -59.89 -46.06 90.53 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.08 -41.51 92.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.114 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.36 -40.5 94.51 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.956 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.37 -43.3 96.69 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 51.5 tp . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.889 179.714 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.753 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -56.94 -36.63 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.863 0.363 . . . . 0.0 110.32 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -58.86 -64.78 0.81 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.853 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -44.87 -42.73 8.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.209 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.11 84.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.214 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -62.04 -41.58 98.27 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.495 HD12 ' N ' ' A' ' 77' ' ' LEU . 10.7 mp -62.86 -43.65 98.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.957 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.36 -47.72 90.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.106 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.681 ' O ' HG23 ' A' ' 83' ' ' VAL . 93.7 mtt-85 -59.51 -43.35 93.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.924 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.501 ' O ' HG13 ' A' ' 84' ' ' ILE . 93.2 m-20 -64.33 -41.26 96.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.389 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.3 -48.33 71.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.008 0.432 . . . . 0.0 110.253 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -66.77 -36.48 82.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.366 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 79' ' ' ARG . 75.1 t -63.85 -47.95 88.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.539 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 80' ' ' ASN . 48.6 mt -61.26 -50.34 80.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.631 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.22 -41.79 94.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.918 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.68 80.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.72 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.29 -44.77 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.844 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -59.47 -34.27 72.35 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.098 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 88.79 17.76 55.86 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--O 1.223 -0.322 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.412 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 N--CA 1.461 0.094 0 CA-C-O 120.836 0.35 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.542 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 68.0 mt-10 -58.5 -33.35 69.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.811 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.76 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 52.7 mtpt -61.09 -48.35 82.11 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.901 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.575 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 13.5 mt -70.57 -46.83 62.75 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.966 0.412 . . . . 0.0 111.939 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.673 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.8 t-105 -59.38 -49.54 77.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.456 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.542 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.0 m-70 -71.16 -32.85 69.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.661 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.76 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 11.6 tptt -55.43 -51.65 66.19 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.949 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.09 -46.79 49.42 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.885 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.412 ' HB2' HD11 ' A' ' 135' ' ' LEU . 58.4 tttm -50.97 -48.75 61.03 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.969 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 12.4 m -83.91 -41.15 17.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.872 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.597 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 8.8 t -46.48 -26.1 0.8 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.296 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -159.09 -94.51 0.1 Allowed Glycine 0 N--CA 1.464 0.536 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.363 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.548 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.2 pttp -161.52 24.08 0.12 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.96 44.74 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.318 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.1 p -103.44 136.42 43.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.083 0.468 . . . . 0.0 111.288 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 97.89 -97.1 1.89 Allowed Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.173 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 94.7 mt-10 -75.11 -43.81 50.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.806 0.336 . . . . 0.0 111.116 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.62 ' O ' HD23 ' A' ' 138' ' ' LEU . 53.3 mp0 -61.82 -54.38 43.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.673 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.8 mt -59.63 -40.51 87.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.323 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -60.77 -44.11 97.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 61.3 mttp -60.55 -44.17 96.42 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.665 HD13 ' OE2' ' A' ' 141' ' ' GLU . 4.5 mm? -57.79 -39.11 76.76 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.607 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -73.28 -29.43 62.73 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.344 -0.843 . . . . 0.0 113.08 177.174 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.512 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 95.3 mtt-85 -57.38 -46.49 83.36 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.097 -1.041 . . . . 0.0 108.243 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.665 ' OE2' HD13 ' A' ' 138' ' ' LEU . 6.1 pt-20 -72.71 -37.65 67.73 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.733 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.607 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.9 m-85 -55.75 -57.26 12.76 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.393 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.787 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 48.6 mt -61.75 -39.22 90.84 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.043 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.512 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 63.4 m170 -54.54 -41.02 69.25 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.758 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -65.28 -45.88 82.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.193 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.787 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 45.4 pttt -59.65 -44.43 93.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.175 -178.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.545 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 74.1 mm-40 -68.24 -48.88 63.94 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.542 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -60.99 -44.21 97.74 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.856 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.84 -45.36 99.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.112 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.702 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.3 m170 -64.59 -34.29 77.91 Favored 'General case' 0 C--O 1.216 -0.699 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.362 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -64.65 -48.04 76.27 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.229 -0.589 . . . . 0.0 110.502 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.424 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 37.2 m-85 -63.95 -46.37 85.01 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.566 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -69.1 -45.18 70.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.837 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 150' ' ' HIS . 71.2 t -64.79 -43.73 96.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.342 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 C--O 1.238 0.5 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.373 -179.13 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 . . . . . 0 C--O 1.238 0.493 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.467 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 8.8 mp -61.78 -38.55 88.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.225 178.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 195' ' ' ARG . 97.9 mttt -67.67 -32.48 73.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.388 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 97.3 mt-10 -67.85 -50.12 58.33 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.023 0.44 . . . . 0.0 111.386 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.469 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 ptmt -71.55 -41.76 68.71 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.373 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.778 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.29 -41.72 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.841 -179.361 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.559 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 14.6 ptm180 -63.46 -39.13 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.7 -41.72 97.98 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 193' ' ' LYS . 85.2 mt -64.2 -43.32 97.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.561 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.475 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.5 m-20 -62.59 -40.86 98.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.247 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.524 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 1.3 mp0 -60.55 -39.17 86.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -62.94 -37.96 95.79 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 201' ' ' LEU . 21.6 mt -63.19 -41.12 99.15 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.717 178.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.543 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.5 OUTLIER -64.2 -35.97 82.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.482 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.5 tmt_? -64.25 -41.15 97.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.915 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.9 mt -61.58 -40.25 94.07 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -61.69 -42.86 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.897 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.577 ' O ' ' HG2' ' A' ' 210' ' ' GLN . 73.5 mtp85 -62.7 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.676 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -62.55 -36.6 75.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 75.4 p -77.37 -26.08 51.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.094 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -95.05 -12.98 25.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.884 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.577 ' HG2' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -131.82 -37.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.303 -179.136 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.629 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.527 0.825 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 120.641 0.258 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -45.91 161.54 0.26 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.88 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -71.29 111.13 3.02 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.527 2.151 . . . . 0.0 112.45 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -170.32 -84.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.845 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.618 HG23 ' N ' ' A' ' 224' ' ' ILE . 2.7 m -61.87 -49.74 83.01 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 CA-C-O 121.506 0.67 . . . . 0.0 110.575 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.618 ' N ' HG23 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -67.25 -26.51 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -66.99 -42.48 84.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.417 0.627 . . . . 0.0 109.318 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.0 tp -61.08 -42.05 97.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.171 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.449 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 48.2 m0 -60.62 -37.76 82.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.848 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -60.7 -39.47 88.66 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 229' ' ' LEU . 92.8 mt -62.44 -42.25 99.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.947 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 227' ' ' TRP . . . -41.19 -32.44 0.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.855 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -68.95 -67.83 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.657 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 91.0 p -66.23 -18.87 65.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.495 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.25 -106.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.653 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -155.83 105.03 2.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.536 HD22 ' OE2' ' A' ' 239' ' ' GLU . 70.9 mt -146.68 168.59 20.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.715 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 69.4 p -80.12 164.43 23.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -63.39 -49.4 73.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.99 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.18 -44.84 94.29 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.566 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . 0.536 ' OE2' HD22 ' A' ' 235' ' ' LEU . 81.6 tt0 -62.95 -36.18 82.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.027 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.749 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.33 -44.05 96.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.985 0.422 . . . . 0.0 110.44 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.64 -55.02 30.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.506 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.36 77.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.065 0.46 . . . . 0.0 110.402 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.418 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.04 -43.8 98.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.283 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -54.14 -54.21 42.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.045 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -62.54 -39.08 92.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.282 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -56.86 -51.96 67.01 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.233 0.54 . . . . 0.0 110.45 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.2 mm? -63.42 -36.86 85.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.772 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.439 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 88.7 tttt -55.94 -48.46 75.7 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.303 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . 0.405 ' O ' ' HD3' ' A' ' 253' ' ' LYS . 19.4 m-70 -66.64 -39.56 88.32 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . 0.457 ' CE2' HD11 ' A' ' 311' ' ' LEU . 3.1 m-85 -62.28 -48.96 77.6 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.005 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.6 pt-20 -61.47 -35.07 76.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.231 0.538 . . . . 0.0 109.644 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.05 83.06 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.282 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . 0.405 ' HD3' ' O ' ' A' ' 249' ' ' HIS . 1.9 mptm? -61.03 -46.59 90.09 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.725 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.505 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.5 tp -63.67 -37.09 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.218 -0.447 . . . . 0.0 109.891 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -56.61 -51.43 68.67 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.036 0.446 . . . . 0.0 109.87 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -61.99 -42.65 99.38 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -55.37 -44.31 75.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.199 0.523 . . . . 0.0 110.199 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -62.12 -40.15 94.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.024 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -57.8 -46.33 84.8 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.117 0.484 . . . . 0.0 110.514 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -63.69 -36.36 83.59 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.505 HE21 ' CG2' ' A' ' 297' ' ' THR . 75.3 mm-40 -58.88 -48.33 81.8 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.03 -44.88 94.33 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -63.34 -37.54 87.68 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.082 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.74 -41.86 97.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.37 -48.13 82.66 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.39 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 63.6 mt -62.15 -42.82 96.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.333 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.65 -36.91 82.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.349 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -63.34 -46.41 86.69 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.091 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.28 -45.72 92.35 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.135 0.493 . . . . 0.0 110.604 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.66 -37.77 85.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.42 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.22 -43.8 98.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.23 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -61.33 -43.24 99.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.309 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . 0.44 ' O ' ' OG ' ' A' ' 276' ' ' SER . 78.2 m80 -69.49 -40.15 77.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.756 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.647 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.6 -38.3 89.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.4 -24.43 67.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.667 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 273' ' ' HIS . 78.7 p -78.59 -5.84 53.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.637 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 274' ' ' ALA . 10.6 p -60.1 -30.13 45.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.444 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 102.42 -72.04 0.32 Allowed Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -65.01 139.09 58.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.779 0.324 . . . . 0.0 110.544 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -92.01 126.77 8.64 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -166.11 -78.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.821 0.343 . . . . 0.0 110.482 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -72.75 -6.63 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 54.7 t -64.2 -45.17 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.533 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 1.1 p -62.2 -44.87 95.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.848 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -62.15 -44.28 96.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 t -60.86 -45.39 94.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.537 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -63.57 -35.29 80.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.417 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -60.8 -61.95 2.21 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.23 0.538 . . . . 0.0 110.363 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.555 ' HD3' HD23 ' A' ' 292' ' ' LEU . 11.4 mmtm -62.01 -35.4 78.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.116 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -51.27 -48.42 62.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.879 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.07 76.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.555 HD23 ' HD3' ' A' ' 289' ' ' LYS . 17.0 tp -62.06 -52.4 64.06 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.55 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 8.8 mp -63.47 -42.59 98.59 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.196 0.522 . . . . 0.0 110.097 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.592 ' O ' ' OG1' ' A' ' 297' ' ' THR . 83.2 tt0 -63.28 -36.37 83.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.817 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.21 -44.13 97.54 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 296' ' ' ARG . 16.5 tpp180 -60.12 -43.11 95.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.468 . . . . 0.0 110.176 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.592 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 19.9 p -58.34 -43.36 88.24 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -39.85 95.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.358 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -58.41 -49.2 78.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.329 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . 0.427 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.7 OUTLIER -60.35 -43.55 96.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.512 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.27 -42.57 82.87 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -63.65 -47.14 82.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.054 0.454 . . . . 0.0 110.655 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . 0.429 HG22 ' ND1' ' A' ' 307' ' ' HIS . 10.8 m -61.5 -43.78 98.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.723 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.39 -41.82 88.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -60.19 -50.38 73.89 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-O 121.153 0.501 . . . . 0.0 110.535 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -63.04 -39.98 96.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.459 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.429 ' ND1' HG22 ' A' ' 303' ' ' THR . 3.4 m170 -66.69 -33.65 76.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.997 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.533 HD21 HG21 ' A' ' 223' ' ' VAL . 3.9 mt -61.81 -46.12 90.89 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.661 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -68.31 -41.89 80.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.52 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.07 -47.17 84.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.886 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.457 HD11 ' CE2' ' A' ' 250' ' ' PHE . 26.8 mt -62.05 -43.2 99.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.964 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 78.4 p -62.74 -36.63 83.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.511 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.27 -45.04 83.84 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . 0.503 ' N ' ' HE ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.85 -43.0 97.44 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.029 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 315' ' ' ILE . 55.8 mt -86.55 -2.62 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.739 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 46.9 t -59.15 -44.3 92.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.299 0.571 . . . . 0.0 109.464 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.5 ptp85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.233 -0.894 . . . . 0.0 108.866 178.961 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 . . . . . 0 C--O 1.234 0.277 0 CA-C-O 120.676 0.274 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.513 ' C ' ' SD ' ' A' ' 22' ' ' MET . 87.7 mtm180 -93.8 8.61 40.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.734 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.513 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -136.21 133.88 37.55 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.263 0.554 . . . . 0.0 110.711 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 58.4 mp0 -65.72 -35.91 82.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.594 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' O ' HD23 ' A' ' 28' ' ' LEU . 64.8 mttp -58.65 -49.38 77.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.102 0.477 . . . . 0.0 110.506 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.89 -34.85 78.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.756 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -66.36 -40.67 89.93 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.54 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -62.97 -45.97 89.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.596 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 24' ' ' LYS . 3.4 mm? -61.88 -41.55 98.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.562 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.645 ' CH2' HD11 ' A' ' 42' ' ' LEU . 55.6 t-105 -62.29 -45.94 91.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.12 0.486 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.62 -45.26 89.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.694 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.24 -41.65 97.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.478 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.34 -41.7 97.48 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.746 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 99.2 mt-30 -61.89 -39.29 91.43 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.076 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.475 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 85.5 mmt-85 -64.47 -38.99 92.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.601 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.7 -39.18 93.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.752 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.746 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 28.6 m80 66.21 106.58 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.818 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.576 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -132.21 155.8 80.86 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.51 179.844 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.437 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 72.5 Cg_exo -42.31 153.38 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.545 2.163 . . . . 0.0 112.364 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 31.0 Cg_exo -59.3 -40.54 67.34 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.734 2.29 . . . . 0.0 112.23 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 79.1 t -62.07 -47.08 94.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.548 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttm-85 -65.8 -42.13 91.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.539 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.645 HD11 ' CH2' ' A' ' 29' ' ' TRP . 48.5 tp -63.6 -45.16 91.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.69 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.77 -46.68 86.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.55 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -66.63 -42.52 86.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.421 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.588 HD13 ' OH ' ' A' ' 88' ' ' TYR . 59.0 tp -63.53 -51.2 66.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.848 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -58.07 -41.96 84.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.481 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.563 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.84 -47.31 86.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.544 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -56.18 -47.36 78.46 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.458 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.426 HD13 ' O ' ' A' ' 45' ' ' LEU . 6.9 mp -59.63 -40.29 87.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.035 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -58.85 -38.36 78.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 47' ' ' ALA . 28.3 mm -63.66 -42.52 96.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.785 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -57.72 -47.2 83.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.542 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -59.8 -50.51 73.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.26 0.552 . . . . 0.0 110.227 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 54' ' ' ARG . 71.3 mmt-85 -62.03 -41.0 97.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.564 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.413 ' OD1' ' O ' ' A' ' 55' ' ' ASP . 66.5 t0 -62.7 -39.28 93.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.543 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -60.03 -47.69 84.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.989 0.423 . . . . 0.0 110.152 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.75 -41.24 97.42 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.366 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.39 98.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.47 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.491 ' CH2' ' HD2' ' A' ' 63' ' ' LYS . 86.5 t90 -60.77 -41.28 95.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.343 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -61.3 -46.93 88.25 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -62.62 -43.14 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.406 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.5 mt -62.18 -41.49 98.37 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.146 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.491 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 88.6 tttt -60.69 -42.05 96.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 179.555 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.49 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.527 0.833 0 N-CA-C 111.014 -0.835 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -68.61 -34.87 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.761 0.315 . . . . 0.0 110.592 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -60.63 -60.74 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.967 0.413 . . . . 0.0 110.251 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 18.0 pt-20 -56.36 -42.09 77.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.135 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.564 ' HB1' HH12 ' A' ' 79' ' ' ARG . . . -60.25 -40.7 91.25 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.265 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -61.3 -40.83 95.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -63.5 -43.36 97.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.128 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.79 -48.73 86.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.745 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.564 HH12 ' HB1' ' A' ' 75' ' ' ALA . 94.8 mtm-85 -60.91 -40.41 93.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.086 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.449 ' O ' HG13 ' A' ' 84' ' ' ILE . 7.2 t-20 -63.41 -37.98 89.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.375 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.687 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.7 -47.53 84.21 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.189 0.519 . . . . 0.0 109.847 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -65.45 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.616 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 79' ' ' ARG . 72.2 t -62.79 -45.54 98.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.356 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.65 -48.39 87.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.268 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.2 mm? -64.95 -41.03 95.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.965 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.23 98.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.655 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -62.54 -48.06 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.538 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.588 ' OH ' HD13 ' A' ' 45' ' ' LEU . 9.6 m-85 -69.07 -23.44 64.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.295 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.25 22.55 75.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.5 mt . . . . . 0 C--N 1.33 -0.273 0 CA-C-O 120.776 0.322 . . . . 0.0 110.484 -179.893 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.449 ' N ' HD12 ' A' ' 117' ' ' LEU . 8.3 mp . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.825 0.345 . . . . 0.0 110.769 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.577 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.9 mt-10 -58.95 -33.31 70.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.478 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 66.6 mttm -61.25 -48.1 82.99 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.639 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.474 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 35.5 mt -66.75 -44.16 82.2 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.773 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.539 ' CD2' HD22 ' A' ' 135' ' ' LEU . 6.8 t-105 -59.22 -50.3 74.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.483 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.577 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.0 m-70 -67.8 -32.2 72.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.266 179.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 127' ' ' SER . 10.8 tptt -56.94 -51.45 69.12 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.82 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.4 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.82 -47.03 64.31 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.554 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -53.86 -50.23 66.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.482 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -73.95 -42.83 59.94 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 123' ' ' LYS . 80.0 p -44.38 -29.58 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.01 0.433 . . . . 0.0 109.917 -178.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -161.4 -96.74 0.11 Allowed Glycine 0 N--CA 1.463 0.44 0 C-N-CA 119.848 -1.168 . . . . 0.0 111.581 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.787 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -154.91 22.75 0.44 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.463 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.2 m-30 -56.36 49.13 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.644 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.787 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -105.82 121.14 43.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.215 -179.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 114.63 -97.08 0.8 Allowed Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.211 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -77.33 -43.93 31.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.784 0.326 . . . . 0.0 110.989 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.463 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 58.5 mp0 -61.64 -51.74 67.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.018 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.539 HD22 ' CD2' ' A' ' 121' ' ' TRP . 1.1 mt -62.14 -40.86 97.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.261 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.69 -43.31 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -60.53 -42.57 96.76 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-O 121.199 0.523 . . . . 0.0 110.138 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mt -58.32 -43.52 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -66.81 -35.24 79.62 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.934 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -54.05 -41.4 68.08 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.076 -1.049 . . . . 0.0 108.227 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.684 ' OE1' HD21 ' A' ' 204' ' ' LEU . 50.5 mt-10 -71.45 -41.73 69.08 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.753 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.474 ' HZ ' HD13 ' A' ' 120' ' ' LEU . 3.5 m-85 -59.39 -57.7 11.83 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.66 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.467 HD23 ' HD2' ' A' ' 146' ' ' LYS . 95.8 mt -60.16 -38.98 84.82 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.206 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -54.99 -46.14 75.1 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.028 -0.669 . . . . 0.0 109.54 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.466 ' CE1' HG23 ' A' ' 197' ' ' ILE . 6.7 m-70 -60.88 -40.01 91.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.681 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.467 ' HD2' HD23 ' A' ' 143' ' ' LEU . 68.1 mttm -60.88 -44.47 97.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.456 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -70.18 -46.4 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.388 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.37 -47.04 85.92 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.05 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 37.3 t -64.56 -41.74 93.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.71 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.747 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -58.17 -44.31 87.9 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.327 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.56 -40.03 95.94 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.98 -50.28 69.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.954 0.406 . . . . 0.0 110.575 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -72.2 -43.75 64.03 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 150' ' ' HIS . 78.9 t -60.3 -46.71 94.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.943 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 79.2 mt . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.708 179.354 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 . . . . . 0 CA--C 1.519 -0.215 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 5.4 mt -62.91 -46.21 88.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -69.69 -42.14 74.51 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.281 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -68.83 -43.01 76.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.565 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.552 ' O ' ' OG ' ' A' ' 196' ' ' SER . 20.5 pttt -74.24 -44.15 54.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.508 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.743 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.36 -41.69 80.28 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.875 -179.629 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.535 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.1 ptm180 -66.24 -37.31 85.2 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.552 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 91.9 p -59.09 -40.0 83.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.466 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.8 mt -63.64 -43.57 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.251 178.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -63.37 -41.02 98.8 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.636 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.456 HE22 HH12 ' A' ' 195' ' ' ARG . 95.8 mt-30 -61.11 -40.45 93.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.456 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.09 -41.26 97.99 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.467 ' HA ' HD23 ' A' ' 201' ' ' LEU . 19.7 mt -62.4 -41.09 98.4 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.059 179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.585 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.3 OUTLIER -63.27 -36.05 82.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.544 ' HA ' ' HE ' ' A' ' 206' ' ' ARG . 3.5 tmm_? -63.46 -42.61 98.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.538 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.684 HD21 ' OE1' ' A' ' 141' ' ' GLU . 40.6 mt -62.15 -40.08 94.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.293 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.523 ' O ' ' ND1' ' A' ' 209' ' ' HIS . 74.4 mtp85 -62.39 -42.67 99.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.086 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.754 ' O ' ' N ' ' A' ' 210' ' ' GLN . 85.2 mtm180 -64.72 -39.32 93.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.183 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.528 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 41.3 t -64.75 -44.32 96.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.105 0.479 . . . . 0.0 110.521 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.6 m -73.93 -26.7 60.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.484 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . 0.523 ' ND1' ' O ' ' A' ' 205' ' ' ARG . 57.0 m80 -100.57 -26.18 13.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.176 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.754 ' N ' ' O ' ' A' ' 206' ' ' ARG . 7.2 tp-100 -119.7 -29.62 4.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.881 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.528 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.482 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.546 ' O ' ' C ' ' A' ' 220' ' ' GLU . 84.2 tt0 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.222 0.058 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.546 ' C ' ' O ' ' A' ' 219' ' ' GLU . 23.7 tt0 27.06 94.3 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.609 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -47.96 82.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.471 2.114 . . . . 0.0 112.132 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 220' ' ' GLU . 56.8 ttm-85 -162.24 -50.9 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.585 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.479 HG23 ' H ' ' A' ' 224' ' ' ILE . 0.0 OUTLIER -64.59 -71.96 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.607 0 CA-C-O 121.328 0.585 . . . . 0.0 110.832 -179.684 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.479 ' H ' HG23 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -60.01 -25.58 33.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.342 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.14 -43.97 85.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.35 0.595 . . . . 0.0 109.64 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.41 -41.97 97.98 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -61.71 -36.66 81.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.798 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.63 -37.45 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.214 0.531 . . . . 0.0 109.745 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.666 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.0 mt -64.39 -41.49 96.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.82 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 235' ' ' LEU . . . -58.54 10.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.868 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.795 ' O ' HD21 ' A' ' 240' ' ' LEU . 2.8 pt20 -76.78 -47.44 21.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.703 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.43 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 76.8 p -129.66 9.52 5.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.644 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 234' ' ' ASN . . . -56.58 -49.6 74.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.578 -179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 233' ' ' ALA . 29.7 t30 173.66 74.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.636 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.494 ' N ' HD12 ' A' ' 235' ' ' LEU . 0.7 OUTLIER -136.05 172.64 12.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 -179.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 43.2 p -94.07 167.02 11.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.72 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -62.52 -48.38 79.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.064 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.95 -45.0 95.58 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.43 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -62.5 -34.9 77.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.634 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.795 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -63.14 -41.51 99.31 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.534 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -63.85 -51.42 64.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.69 98.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.1 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -64.04 -43.14 96.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.91 178.838 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -57.3 -51.19 70.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.358 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -66.51 -40.37 89.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.585 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -59.36 -51.04 71.65 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.402 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.414 ' HG ' ' CE2' ' A' ' 243' ' ' PHE . 4.3 mm? -64.29 -37.04 86.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.563 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.691 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 33.6 ttpt -56.46 -43.8 79.92 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.192 0.52 . . . . 0.0 110.184 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -69.58 -42.71 74.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.488 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . 0.524 ' CE2' HD11 ' A' ' 311' ' ' LEU . 3.1 m-85 -61.93 -48.74 79.05 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.21 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.691 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 2.5 pp20? -60.27 -38.33 83.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.134 0.492 . . . . 0.0 109.905 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 251' ' ' GLU . . . -66.64 -36.59 82.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.366 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.23 -47.61 83.67 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.174 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.457 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.7 OUTLIER -65.1 -41.91 93.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.592 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . 0.401 ' N ' HG23 ' A' ' 254' ' ' ILE . 49.6 tp10 -61.4 -46.73 88.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.319 0.58 . . . . 0.0 110.112 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.57 -41.72 98.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.332 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -55.02 -45.44 75.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.124 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -61.3 -42.94 99.5 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.15 0.5 . . . . 0.0 110.19 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.4 -41.18 96.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.166 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . 0.425 ' O ' ' N ' ' A' ' 264' ' ' LEU . 26.0 m-85 -63.65 -37.29 86.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.522 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.481 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 35.3 mm-40 -60.3 -52.02 67.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.229 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.69 -45.31 94.66 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.081 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -67.37 -30.44 70.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.277 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' A' ' 260' ' ' TYR . 46.4 tp -63.52 -45.4 90.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.047 0.451 . . . . 0.0 110.308 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.37 -47.63 69.84 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.519 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 97.6 mt -62.42 -43.06 97.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.943 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.056 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -59.56 -46.94 87.43 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.08 0.466 . . . . 0.0 110.193 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -62.6 -43.82 97.85 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.278 0.561 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.08 -39.51 90.18 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.327 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.728 ' C ' HD23 ' A' ' 271' ' ' LEU . 7.4 tt -59.85 -43.83 94.44 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.3 ttt85 -58.45 -44.46 89.24 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.126 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -68.52 -40.2 80.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.567 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.619 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -57.24 -44.21 83.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.692 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . 0.587 ' OE2' HD21 ' A' ' 271' ' ' LEU . 92.2 mt-10 -61.66 -22.28 65.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.494 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.5 t -91.85 5.84 48.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.626 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.619 HG12 ' O ' ' A' ' 274' ' ' ALA . 14.5 p -62.44 -43.66 98.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.61 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.556 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 166.41 -111.83 0.47 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -61.53 -41.01 96.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.78 0.324 . . . . 0.0 110.563 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 281' ' ' GLU . . . 152.72 -111.69 0.5 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . 0.636 ' C ' ' H ' ' A' ' 283' ' ' VAL . 95.5 mt-10 58.9 152.66 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' A' ' 281' ' ' GLU . 96.8 mtt180 64.26 -19.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . 0.636 ' H ' ' C ' ' A' ' 281' ' ' GLU . 8.9 p -67.91 -47.42 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.696 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . 0.596 ' N ' HG13 ' A' ' 283' ' ' VAL . 42.1 m -63.41 -44.94 93.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.941 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -65.73 -43.53 88.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.833 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 59.1 m -61.11 -44.98 96.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.794 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . 0.553 ' NH2' ' OE2' ' A' ' 275' ' ' GLU . 94.8 mtt-85 -66.03 -39.61 90.34 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.189 0.519 . . . . 0.0 111.045 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.97 -59.21 5.82 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.073 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.647 ' HD3' HD23 ' A' ' 292' ' ' LEU . 54.6 mmtt -63.41 -39.88 95.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.07 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -41.81 -57.78 2.24 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.382 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.37 80.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.717 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.647 HD23 ' HD3' ' A' ' 289' ' ' LYS . 35.6 tp -60.65 -49.87 75.77 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.499 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . 0.442 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.8 mp -64.93 -41.63 95.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.978 0.418 . . . . 0.0 110.06 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -58.93 -45.35 90.59 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.182 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.28 -43.83 98.54 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -62.72 -38.87 92.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.419 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.481 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 1.5 m -60.75 -51.71 68.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.395 0.617 . . . . 0.0 110.076 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -65.3 -44.95 86.27 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.246 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -58.39 -38.01 76.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.987 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 300' ' ' LEU . 0.2 OUTLIER -62.72 -42.82 99.85 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.66 -46.19 93.68 Favored Glycine 0 CA--C 1.53 1.009 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.62 -43.51 93.75 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 110.45 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.8 m -60.26 -41.64 93.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.128 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.83 -43.86 89.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -57.6 -55.11 39.07 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.244 0.545 . . . . 0.0 110.619 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -62.73 -38.47 90.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.425 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -63.35 -38.01 89.51 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.279 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 6.8 mt -62.02 -44.56 96.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.343 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? -70.59 -43.2 69.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.704 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -63.34 -46.02 88.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.836 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 250' ' ' PHE . 23.9 mt -63.43 -42.11 98.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.92 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 67.8 m -58.97 -44.29 91.5 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.362 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -71.04 -36.64 64.35 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -63.2 -43.89 96.91 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.732 0.301 . . . . 0.0 110.758 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . 0.591 ' O ' ' N ' ' A' ' 317' ' ' ARG . 2.3 mt -81.29 -97.16 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.904 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 315' ' ' ILE . 0.4 OUTLIER 35.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.095 0.474 . . . . 0.0 110.444 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.591 ' N ' ' O ' ' A' ' 315' ' ' ILE . 17.6 ptp180 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.465 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.435 ' CD1' HD23 ' A' ' 25' ' ' LEU . 67.0 m-85 . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.74 0.305 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 21' ' ' ARG . 68.3 mtt180 -94.4 16.45 15.14 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.901 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.581 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.5 mmt -142.29 133.9 26.75 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.113 0.482 . . . . 0.0 111.217 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -67.3 -43.99 80.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.539 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -60.01 -45.69 91.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.419 0.628 . . . . 0.0 110.5 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.435 HD23 ' CD1' ' A' ' 20' ' ' PHE . 5.3 tp -60.76 -38.77 86.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.402 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.581 ' ND2' ' O ' ' A' ' 22' ' ' MET . 49.6 m-80 -62.37 -39.29 92.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.814 179.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -57.59 -46.25 84.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.258 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -61.42 -43.2 99.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.095 0.474 . . . . 0.0 110.41 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.404 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 24.8 t-105 -60.91 -45.41 94.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.235 0.54 . . . . 0.0 110.595 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.41 -40.61 87.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.264 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.402 ' HG2' ' NH2' ' A' ' 34' ' ' ARG . 67.3 mttm -60.57 -43.3 97.44 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.255 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.99 97.17 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.284 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.541 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 77.3 mt-30 -58.16 -45.07 88.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.344 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.486 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 93.7 mtm-85 -65.65 -33.98 77.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.48 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.459 HD12 ' HA ' ' A' ' 35' ' ' LEU . 14.3 tp -62.09 -37.57 85.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.127 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.541 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 26.8 m80 65.94 109.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 mt -139.3 154.96 72.4 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.02 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 154.6 0.1 OUTLIER 'Trans proline' 0 C--N 1.312 -1.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.26 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.14 -34.7 16.02 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.461 2.108 . . . . 0.0 112.321 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.49 -48.91 81.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.617 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -69.94 -39.97 75.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.586 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.7 -43.89 95.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.586 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.09 -44.4 84.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.612 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -66.88 -45.73 77.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.643 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.405 HD22 ' OH ' ' A' ' 88' ' ' TYR . 57.1 tp -62.67 -47.91 81.61 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.534 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -59.03 -40.71 85.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.973 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.93 -45.13 93.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.812 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.07 -46.4 85.5 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.915 0.388 . . . . 0.0 110.409 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 40.6 mt -60.01 -40.84 90.65 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.128 0.489 . . . . 0.0 110.158 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -59.0 -39.64 82.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.059 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.4 mm -62.13 -43.8 98.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.648 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -55.74 -44.83 77.95 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.389 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -60.41 -46.73 88.94 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.261 0.553 . . . . 0.0 110.425 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.62 -43.34 93.84 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.7 -38.64 85.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.115 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -58.07 -47.32 83.52 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 16.0 mt -60.84 -42.6 98.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.391 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.09 99.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.5 t90 -57.6 -43.14 84.46 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.135 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.66 -45.87 92.19 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.03 0.443 . . . . 0.0 109.931 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.09 -44.45 91.91 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.431 ' CD2' ' NZ ' ' A' ' 73' ' ' LYS . 7.2 mp -62.72 -39.04 92.82 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.848 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.51 -44.55 76.73 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 30.6 mt . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.038 179.131 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.776 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -60.46 -33.97 73.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.431 ' NZ ' ' CD2' ' A' ' 62' ' ' LEU . 98.4 mttt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.042 0.449 . . . . 0.0 110.096 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -58.07 -42.88 86.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.147 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.51 92.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.371 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.407 ' HA ' ' HE ' ' A' ' 79' ' ' ARG . 61.3 ttp180 -60.37 -42.73 96.42 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.62 -42.83 99.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.7 -45.52 97.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.626 ' O ' HG23 ' A' ' 83' ' ' VAL . 88.8 mtm180 -61.58 -41.73 97.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.205 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -63.9 -38.94 92.95 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.294 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.741 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.9 tm? -59.54 -48.52 81.32 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.755 -0.778 . . . . 0.0 109.841 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -63.6 -38.67 92.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.639 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 79' ' ' ARG . 78.2 t -62.81 -46.42 96.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.346 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.32 -48.89 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.52 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.49 -40.8 93.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.4 . . . . 0.0 110.897 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.85 -47.74 83.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.68 -44.13 97.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.104 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.405 ' OH ' HD22 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -63.43 -34.69 78.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.106 0.479 . . . . 0.0 109.954 179.739 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.46 25.9 55.76 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' ' 90' ' ' LEU . 45.9 mt . . . . . 0 C--O 1.231 0.107 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.513 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.237 0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.408 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.597 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 99.1 mt-10 -54.84 -24.65 24.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.259 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 57.0 mtpt -60.15 -49.72 76.53 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.096 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.87 -44.75 69.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.975 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.69 ' CE2' HD13 ' A' ' 135' ' ' LEU . 9.2 t-105 -59.07 -48.84 80.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.49 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.597 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.435 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.2 OUTLIER -55.91 -51.28 68.16 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.729 -178.812 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.29 -46.7 63.76 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.814 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -51.68 -51.53 55.18 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.648 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -76.68 -41.99 43.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.821 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.9 t -45.55 -27.34 0.73 Allowed 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.062 0.458 . . . . 0.0 109.912 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.12 -91.79 0.08 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.426 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.541 ' O ' ' N ' ' A' ' 131' ' ' SER . 11.8 ptmt -165.62 31.03 0.05 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.413 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -65.13 43.4 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.341 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.541 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -98.36 123.54 42.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.651 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 112.7 -97.29 0.88 Allowed Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.076 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -78.61 -43.24 26.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.749 0.309 . . . . 0.0 111.246 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 77.3 mm-40 -60.97 -51.97 66.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 0.0 110.142 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.69 HD13 ' CE2' ' A' ' 121' ' ' TRP . 2.2 mt -62.43 -42.89 99.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.035 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.21 -39.95 92.15 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 2.9 mmpt? -61.49 -42.1 98.28 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.281 0.562 . . . . 0.0 109.869 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mt -58.05 -43.39 86.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -36.15 82.74 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 176.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.507 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 6.5 mpt_? -54.12 -42.95 70.03 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.522 ' OE1' ' O ' ' A' ' 137' ' ' LYS . 5.6 mp0 -70.09 -41.86 73.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.825 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -61.06 -53.73 53.52 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.693 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 98.9 mt -59.92 -40.71 89.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.097 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' A' ' 140' ' ' ARG . 6.4 m80 -56.48 -44.28 80.48 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.478 ' O ' HG12 ' A' ' 149' ' ' VAL . 9.5 m-70 -63.28 -38.68 92.11 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.592 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -60.82 -43.14 98.6 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.106 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.722 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 98.1 mt-10 -69.83 -45.71 67.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.002 0.429 . . . . 0.0 111.684 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -70.65 -44.53 66.9 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.481 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.6 HG13 ' N ' ' A' ' 150' ' ' HIS . 4.4 p -63.44 -49.34 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.983 -178.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.783 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -70.51 -23.25 62.62 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.004 -179.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.682 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 24.6 mt-10 -67.18 -52.28 43.3 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.814 179.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -63.25 -41.53 99.07 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -63.92 -40.1 95.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.231 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 150' ' ' HIS . 19.8 t -60.38 -47.65 91.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.042 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 97.2 mt . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.844 179.907 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 . . . . . 0 CA--C 1.521 -0.173 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 5.3 mt -62.3 -46.68 87.69 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.556 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.442 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.8 mttt -68.6 -38.27 80.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.942 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 85.4 tt0 -67.81 -48.21 66.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.764 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 14.3 pttt -73.2 -41.18 64.09 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.011 -179.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.705 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.52 -41.77 72.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.849 -179.4 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.523 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 12.8 ptm180 -65.72 -38.99 90.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.0 -42.29 98.16 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 193' ' ' LYS . 82.2 mt -64.42 -43.86 97.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.761 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -62.09 -41.7 98.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.504 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.29 -31.94 73.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.338 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.57 78.41 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 201' ' ' LEU . 24.8 mt -63.22 -40.8 98.5 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.864 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.56 -39.96 93.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -41.76 99.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.497 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.449 HD12 HD23 ' A' ' 201' ' ' LEU . 31.9 mt -60.9 -40.66 93.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.449 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -62.2 -44.24 97.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.294 0.569 . . . . 0.0 109.668 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.547 ' O ' ' N ' ' A' ' 210' ' ' GLN . 24.2 mmt85 -63.73 -39.54 94.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.069 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 211' ' ' GLY . 48.5 t -62.99 -45.64 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.042 0.449 . . . . 0.0 109.897 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 15.6 m -63.39 -29.51 70.8 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.339 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.9 m170 -93.57 -46.03 7.47 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.69 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 206' ' ' ARG . 2.9 pp0? -105.56 -25.57 12.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.657 0.265 . . . . 0.0 111.112 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 N--CA 1.459 0.202 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 . . . . . 0 C--O 1.233 0.193 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.97 151.24 86.31 Favored Pre-proline 0 C--O 1.235 0.325 0 C-N-CA 119.136 -1.025 . . . . 0.0 108.314 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.616 ' O ' ' N ' ' A' ' 223' ' ' VAL . 78.0 Cg_exo -38.26 -79.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.28 1.987 . . . . 0.0 112.418 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.413 ' H ' ' HB2' ' A' ' 221' ' ' PRO . 43.6 ttm180 36.09 -84.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.092 0.472 . . . . 0.0 111.402 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.817 HG11 HD21 ' A' ' 308' ' ' LEU . 2.1 t -59.75 -65.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.139 0.495 . . . . 0.0 110.691 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.414 HD11 ' HE1' ' A' ' 250' ' ' PHE . 1.1 mp -51.19 -28.03 6.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.754 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . 0.409 ' HB3' ' O ' ' A' ' 222' ' ' ARG . 56.6 t0 -63.51 -45.91 88.47 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 109.868 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.1 mt -61.2 -42.13 98.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.596 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.452 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 44.2 m0 -61.49 -36.67 81.12 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.355 -0.538 . . . . 0.0 109.949 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.8 -40.21 94.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 231' ' ' GLN . 96.8 mt -64.02 -41.81 97.33 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.263 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 227' ' ' TRP . . . -36.68 -29.39 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.999 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 229' ' ' LEU . 89.1 mt-30 -62.49 -65.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.715 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 5.4 t -87.05 14.69 7.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.688 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -80.47 -76.1 0.24 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.805 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -173.26 81.66 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.905 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 76.5 mt -141.54 149.26 40.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.615 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 240' ' ' LEU . 70.4 p -71.3 -167.01 0.2 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.407 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 237' ' ' ASP . 27.0 p-10 -82.53 -47.82 11.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.327 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . 0.401 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 65.1 mttp -63.38 -44.33 95.03 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.081 0.467 . . . . 0.0 110.625 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -62.3 -36.45 82.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.686 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.758 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.2 -45.0 93.73 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.535 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -62.08 -46.73 87.81 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.465 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -63.24 -40.85 98.6 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.06 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.526 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -65.71 -43.73 88.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.52 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . 0.401 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 0.0 OUTLIER -59.99 -48.21 82.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.009 0.433 . . . . 0.0 110.441 -178.703 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -65.19 -46.08 82.2 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.825 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -57.27 -50.17 73.76 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.071 0.462 . . . . 0.0 110.345 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.97 -37.39 87.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.687 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.4 tttt -55.28 -47.63 75.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.061 0.458 . . . . 0.0 109.866 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -67.48 -43.77 80.16 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.076 -0.649 . . . . 0.0 110.989 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . 0.436 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 29.9 t80 -60.65 -48.06 83.46 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.509 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.9 OUTLIER -61.86 -36.63 81.81 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.04 -41.6 90.66 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.826 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.45 -46.9 86.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 111.137 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -38.81 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.791 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -55.83 -48.8 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.343 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -62.24 -43.11 99.57 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.26 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -57.83 -43.1 85.6 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.131 0.491 . . . . 0.0 110.291 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -61.52 -40.97 96.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.364 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -59.18 -46.69 87.74 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 120.954 0.407 . . . . 0.0 110.285 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . 0.56 ' CD2' HD11 ' A' ' 293' ' ' LEU . 3.3 m-85 -62.07 -37.5 85.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.28 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.549 HE21 ' CG2' ' A' ' 297' ' ' THR . 90.0 mm-40 -61.6 -42.62 99.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.524 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 24.1 mmtp -62.0 -45.64 92.74 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.098 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -66.34 -35.99 81.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.148 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.31 -43.73 98.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.39 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.46 -45.38 83.98 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.677 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 55.9 mt -62.97 -43.27 98.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.734 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.14 -38.63 83.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.035 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.29 -47.42 86.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.407 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -58.43 -48.85 79.37 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.361 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -61.11 -37.66 83.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.729 ' O ' HD23 ' A' ' 271' ' ' LEU . 4.7 tt -59.81 -44.26 94.07 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 -179.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -61.35 -44.81 96.55 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.078 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.49 -44.6 82.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.863 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.03 -34.69 73.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -59.92 -35.16 74.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.962 0.411 . . . . 0.0 110.116 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 15.6 m -61.25 -31.47 71.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.834 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.34 -44.04 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.453 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 105.03 6.1 40.12 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . 0.433 ' O ' HG23 ' A' ' 283' ' ' VAL . 48.9 t0 -84.35 100.47 11.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.379 . . . . 0.0 110.127 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.3 86.87 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -55.58 -50.8 69.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.582 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -66.53 -38.28 86.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.93 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 279' ' ' ASP . 72.5 t -60.87 -47.29 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.48 -46.4 88.65 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.054 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -62.44 -43.03 99.81 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.706 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.2 t -60.47 -45.14 94.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.459 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -64.07 -36.65 84.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.708 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.61 -58.87 6.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.551 ' HD3' HD23 ' A' ' 292' ' ' LEU . 28.5 mmtt -64.34 -33.48 75.94 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.061 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 -55.26 -48.67 73.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.443 -0.503 . . . . 0.0 109.919 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.84 -39.1 80.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.964 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.551 HD23 ' HD3' ' A' ' 289' ' ' LYS . 8.5 tp -62.28 -54.92 33.71 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.736 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . 0.56 HD11 ' CD2' ' A' ' 260' ' ' TYR . 9.8 tp -62.65 -42.43 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.181 0.515 . . . . 0.0 109.958 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.484 ' O ' ' OG1' ' A' ' 297' ' ' THR . 81.7 tt0 -63.35 -36.98 85.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.993 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.47 -45.71 94.21 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -60.56 -44.03 96.63 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.056 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.549 ' CG2' HE21 ' A' ' 261' ' ' GLN . 21.9 p -59.39 -39.84 84.66 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.563 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.77 -47.47 83.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.029 0.442 . . . . 0.0 110.838 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.2 -41.29 92.67 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.092 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . 0.43 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.1 OUTLIER -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.953 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.44 -40.0 91.47 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -61.54 -46.7 88.82 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 110.486 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 17.7 m -60.34 -45.21 94.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.542 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.98 -42.18 91.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.854 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -56.59 -48.75 76.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.752 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -61.56 -42.89 99.5 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.185 0.517 . . . . 0.0 110.457 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -68.95 -31.09 69.71 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.311 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.817 HD21 HG11 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -61.94 -49.01 77.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.327 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . 0.421 ' HG3' ' N ' ' A' ' 310' ' ' ASP . 12.5 pt20 -67.88 -42.0 81.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . 0.444 ' OD1' ' NE ' ' A' ' 314' ' ' ARG . 48.4 t0 -62.29 -51.1 69.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.995 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.45 -40.19 95.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.883 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 66.5 m -58.58 -44.79 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.64 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -70.13 -45.47 55.98 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.462 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . 0.444 ' NE ' ' OD1' ' A' ' 310' ' ' ASP . 95.1 mtt-85 -63.44 -47.52 81.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.724 0.297 . . . . 0.0 111.23 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -65.59 -43.19 94.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.643 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.0 p -58.51 -38.08 76.94 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.508 -0.477 . . . . 0.0 109.932 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 43.2 tpt85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.775 -179.573 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 C--O 1.233 0.22 0 CA-C-O 120.826 0.346 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -65.47 -34.62 78.7 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.0 mmm -124.18 149.92 45.78 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.405 0.621 . . . . 0.0 110.648 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 52.5 mp0 -61.62 -41.71 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.424 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -46.08 -57.04 4.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.173 0.511 . . . . 0.0 110.494 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.5 mt -59.79 -35.38 74.55 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.867 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -64.55 -39.35 93.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.394 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.36 -46.87 88.41 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.14 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -59.77 -41.82 91.91 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.46 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 29.1 t-105 -59.92 -43.41 94.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 0.0 110.401 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -57.9 -41.98 83.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.206 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -61.25 -41.58 97.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.39 95.17 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.324 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.473 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 76.6 mt-30 -62.39 -38.4 89.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.32 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.527 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.0 mt -65.27 -38.37 90.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.446 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.35 109.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.3 mt -134.42 154.9 80.07 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -37.91 154.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.816 2.344 . . . . 0.0 112.202 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.95 -47.02 2.73 Favored 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.736 2.29 . . . . 0.0 112.551 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.432 HG23 ' N ' ' A' ' 41' ' ' ARG . 5.6 m -61.31 -47.18 94.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.452 -179.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.432 ' N ' HG23 ' A' ' 40' ' ' VAL . 61.4 ttm-85 -64.9 -40.64 95.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.434 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.14 -43.92 97.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.58 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.69 97.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.514 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -66.19 -47.09 75.06 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.618 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.01 -47.75 85.0 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.374 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -59.24 -41.25 88.3 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.293 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.415 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.55 -44.46 93.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.391 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -58.4 -45.79 87.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.137 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.1 mt -58.51 -41.49 85.53 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.178 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -59.15 -39.84 83.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.062 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.0 mm -63.09 -43.02 98.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.858 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -56.4 -47.49 78.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.263 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -61.32 -44.36 97.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.107 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -60.02 -45.49 92.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.577 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.563 ' OD2' HD21 ' A' ' 77' ' ' LEU . 43.7 t0 -63.1 -37.83 88.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.655 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.0 -49.52 77.11 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.274 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.3 tp -59.44 -41.15 88.93 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.19 0.519 . . . . 0.0 110.163 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.56 -50.97 71.37 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.568 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.409 ' O ' ' HG ' ' A' ' 62' ' ' LEU . 70.5 t90 -57.82 -38.86 76.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.423 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -57.1 -45.77 83.13 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -60.59 -48.93 79.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.178 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.8 HD12 ' C ' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.03 -35.65 80.93 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.025 -0.67 . . . . 0.0 109.641 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.447 ' N ' ' HG ' ' A' ' 62' ' ' LEU . 29.3 tptp -61.26 -41.26 96.62 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 34.9 tp . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.734 179.194 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.816 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -66.2 -32.67 74.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.713 0.292 . . . . 0.0 110.343 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.63 -49.45 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.268 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -62.33 -44.0 97.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.359 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.31 90.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.452 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -62.6 -42.45 99.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.911 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.563 HD21 ' OD2' ' A' ' 55' ' ' ASP . 84.5 mt -62.85 -44.57 95.77 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.057 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.65 -47.36 91.57 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.266 0.555 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.603 ' O ' HG23 ' A' ' 83' ' ' VAL . 60.8 ttp180 -61.35 -40.89 95.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.049 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -60.7 -41.2 94.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.373 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.654 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -60.21 -47.43 85.98 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.253 0.549 . . . . 0.0 110.049 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 28.6 t-20 -67.42 -37.53 83.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.56 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 79' ' ' ARG . 43.5 t -62.43 -48.27 89.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.441 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -61.44 -48.33 89.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.536 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.99 -42.19 97.26 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.85 87.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.348 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.76 -47.29 85.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.497 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -76.12 -21.14 56.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.439 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.98 27.51 70.33 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 90' ' ' LEU . 41.6 mt . . . . . 0 C--N 1.33 -0.253 0 CA-C-O 120.662 0.267 . . . . 0.0 110.592 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.578 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.0 mp . . . . . 0 N--CA 1.457 -0.096 0 CA-C-O 120.825 0.345 . . . . 0.0 110.714 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.605 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 99.1 mt-10 -56.17 -31.34 63.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.071 0.462 . . . . 0.0 110.444 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.593 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 99.6 mttt -64.66 -48.12 75.95 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.533 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 120' ' ' LEU . 50.7 mt -71.42 -45.83 61.71 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.983 0.42 . . . . 0.0 111.889 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.579 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.4 t-105 -58.67 -48.69 80.23 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.605 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.2 m-70 -69.87 -32.59 71.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.378 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 13.1 tptt -59.31 -48.55 81.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.733 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.98 -47.61 65.16 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.696 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -57.23 -49.51 75.79 Favored 'General case' 0 C--O 1.23 0.04 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.121 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 5.2 m -74.91 -46.43 36.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.74 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 41.7 p -45.85 -29.26 1.3 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.122 -178.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -155.72 -95.63 0.11 Allowed Glycine 0 N--CA 1.463 0.489 0 C-N-CA 119.928 -1.129 . . . . 0.0 111.173 179.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.597 ' O ' ' N ' ' A' ' 131' ' ' SER . 26.9 mttm -163.86 27.87 0.08 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.492 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.6 m-30 -63.5 44.58 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.651 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.597 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.5 p -100.95 112.4 24.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.436 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 124.98 -97.12 0.53 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.076 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 134' ' ' GLU . 12.7 pt-20 -78.17 -42.88 30.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.854 0.359 . . . . 0.0 110.841 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.492 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 53.0 mp0 -60.63 -53.56 55.98 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.948 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.579 HD22 ' CE3' ' A' ' 121' ' ' TRP . 2.8 mt -61.84 -41.18 97.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.175 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -60.0 -44.53 94.49 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.085 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -59.61 -43.84 93.62 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.0 mm? -59.31 -42.53 91.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.293 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.532 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -64.94 -37.82 88.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.42 -0.809 . . . . 0.0 113.027 176.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 94.5 mtt180 -52.37 -43.72 64.85 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.64 -40.1 76.72 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.776 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.532 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.2 m-85 -58.36 -55.22 37.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.33 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 59.9 mt -59.66 -38.48 81.57 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.22 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.428 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 54.0 m170 -54.1 -47.66 71.53 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.848 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -61.71 -39.19 90.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -60.34 -41.98 94.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.26 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -65.01 -55.17 20.52 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.823 0.344 . . . . 0.0 111.297 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.43 -45.22 94.08 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.987 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.468 HG22 HD13 ' A' ' 197' ' ' ILE . 51.5 t -64.1 -35.5 73.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.949 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.789 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -66.1 -41.75 90.2 Favored 'General case' 0 C--O 1.209 -1.042 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.014 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.9 -43.65 98.24 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.091 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.49 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 17.1 m-85 -70.5 -46.45 63.67 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.544 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . 0.46 ' ND2' ' CG1' ' A' ' 149' ' ' VAL . 89.5 m-20 -67.55 -42.59 82.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.59 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 150' ' ' HIS . 76.2 t -61.54 -47.05 95.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.034 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 155' ' ' LEU . 46.5 mt . . . . . 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.62 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.893 0.378 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 8.1 mp -62.83 -42.64 99.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.691 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.505 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.1 mttm -67.97 -34.2 76.09 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.935 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.544 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.6 tt0 -67.69 -47.6 68.97 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.218 0.532 . . . . 0.0 111.362 -178.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.49 ' CE ' ' CD1' ' A' ' 152' ' ' TYR . 12.4 ptmt -73.28 -40.64 64.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.44 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.822 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.9 -40.29 75.72 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.818 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.687 ' NH1' HE22 ' A' ' 199' ' ' GLN . 3.4 ppt_? -65.6 -37.56 86.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 89.6 p -62.67 -43.88 97.68 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.468 HD13 HG22 ' A' ' 149' ' ' VAL . 96.8 mt -65.86 -43.34 93.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.782 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -60.87 -40.93 94.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.361 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.687 HE22 ' NH1' ' A' ' 195' ' ' ARG . 31.8 mt-30 -63.08 -38.56 91.66 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.576 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.76 -43.89 98.6 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 204' ' ' LEU . 18.9 mt -64.39 -39.04 93.09 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.01 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -59.76 -39.96 86.57 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.498 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 6.4 tmm_? -63.1 -42.68 99.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.393 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 201' ' ' LEU . 43.6 mt -61.86 -40.62 96.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.396 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -61.44 -41.68 97.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.749 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.704 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.1 mtp180 -62.3 -40.84 97.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.365 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.609 ' O ' ' N ' ' A' ' 211' ' ' GLY . 43.0 t -63.52 -46.09 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.083 0.468 . . . . 0.0 110.313 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -69.84 -26.65 64.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.508 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 41.1 m170 -101.81 -14.49 17.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.147 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 206' ' ' ARG . 64.1 tp60 -132.27 -37.84 1.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.765 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.609 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.555 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 . . . . . 0 N--CA 1.464 0.259 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 221' ' ' PRO . 32.4 mm-40 -89.65 150.95 45.16 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.615 ' O ' ' HB3' ' A' ' 222' ' ' ARG . 51.1 Cg_exo -51.54 -155.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.771 2.314 . . . . 0.0 111.874 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 221' ' ' PRO . 41.5 ttm180 87.62 -102.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.71 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.552 HG13 ' N ' ' A' ' 224' ' ' ILE . 14.4 p -59.15 -44.95 92.89 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 110.636 -179.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.552 ' N ' HG13 ' A' ' 223' ' ' VAL . 4.1 mm -61.6 -41.14 89.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.075 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -60.98 -39.65 90.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.91 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 7.7 mt -59.71 -41.81 91.64 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.28 0.562 . . . . 0.0 109.769 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.55 ' CZ3' HD13 ' A' ' 224' ' ' ILE . 54.8 m0 -61.42 -43.04 99.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.916 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.56 -25.52 65.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 232' ' ' SER . 2.8 mt -65.39 -43.33 91.02 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.93 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.438 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -34.8 -44.22 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.794 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.403 ' HB2' HE21 ' A' ' 231' ' ' GLN . 6.8 tt0 -62.6 -47.91 81.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.652 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.547 ' O ' ' O ' ' A' ' 233' ' ' ALA . 35.7 t -67.6 -40.02 84.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.565 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . 0.547 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -47.93 -111.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.732 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -157.43 111.72 2.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 78.2 mt -146.36 161.64 39.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.579 ' OG1' ' HG2' ' A' ' 239' ' ' GLU . 0.0 OUTLIER -83.1 165.43 19.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.686 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -60.65 -47.38 86.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.991 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.1 -47.43 85.31 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 110.552 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . 0.579 ' HG2' ' OG1' ' A' ' 236' ' ' THR . 5.7 mm-40 -66.3 -35.77 81.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.002 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.798 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.11 -43.31 98.79 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.206 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -63.01 -48.99 76.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.398 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.69 -44.18 97.43 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.344 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.474 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -62.41 -43.87 97.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.122 179.062 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -59.37 -46.69 87.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.047 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -66.19 -44.07 85.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.706 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -59.66 -49.59 77.14 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.597 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.6 mm? -62.65 -38.32 89.84 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.525 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.41 -41.14 84.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.829 0.347 . . . . 0.0 110.071 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -66.51 -61.01 2.21 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.555 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . 0.434 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 25.3 t80 -59.58 -45.76 90.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.511 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.6 tp10 -54.88 -38.51 67.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.163 0.506 . . . . 0.0 109.701 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.31 82.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.244 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -60.72 -47.94 84.03 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.857 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.469 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 2.6 tp -63.49 -37.39 79.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.126 179.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -59.66 -44.02 93.72 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 121.07 0.462 . . . . 0.0 109.888 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -63.27 -42.41 99.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.134 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . 0.495 ' NE2' HG22 ' A' ' 297' ' ' THR . 15.5 t-80 -56.93 -42.43 80.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.159 0.504 . . . . 0.0 110.127 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -63.24 -40.0 96.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.084 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . 0.456 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -58.35 -46.58 86.0 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.147 0.499 . . . . 0.0 110.338 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -62.98 -35.68 80.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.201 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.48 ' NE2' HG21 ' A' ' 297' ' ' THR . 32.8 mm-40 -60.48 -45.02 95.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.117 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -62.05 -43.76 98.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.209 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . 0.456 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.8 mp0 -66.92 -37.86 85.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.203 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . 0.891 HD21 ' OE1' ' A' ' 294' ' ' GLU . 53.9 tp -62.39 -43.54 98.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.294 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -66.21 -45.39 80.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.429 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 51.8 mt -62.94 -43.22 98.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.243 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.68 -37.82 82.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.253 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.77 -45.49 86.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.446 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -62.81 -46.44 87.96 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.618 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 60.5 tptt -60.48 -42.08 95.52 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.658 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.644 HD13 ' CB ' ' A' ' 286' ' ' SER . 35.4 tp -61.78 -43.15 99.43 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.27 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -58.13 -42.81 86.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.176 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -73.56 -33.71 64.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.506 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.744 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -64.04 -40.78 97.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.656 -179.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -54.26 -18.9 4.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.892 0.377 . . . . 0.0 110.594 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 4.1 t -62.32 -32.86 73.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.636 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.744 HG12 ' O ' ' A' ' 274' ' ' ALA . 10.4 p -58.67 -45.16 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.421 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.585 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 79.0 -10.26 34.42 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . 0.547 ' H ' HG13 ' A' ' 277' ' ' VAL . 54.1 m-20 -61.78 -38.6 88.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.661 0.267 . . . . 0.0 110.549 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . 0.661 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 98.11 -146.49 18.22 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . 0.458 ' OE1' ' C ' ' A' ' 280' ' ' GLY . 51.5 mp0 57.97 -65.03 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 110.778 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . 0.661 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -63.33 -37.97 89.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.665 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.81 -46.74 95.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.518 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . 0.451 ' O ' ' OE1' ' A' ' 288' ' ' GLU . 12.0 t -63.1 -47.44 82.84 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.052 0.454 . . . . 0.0 110.933 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 73.3 ttp85 -64.11 -42.99 96.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.82 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . 0.644 ' CB ' HD13 ' A' ' 271' ' ' LEU . 42.1 t -60.28 -43.79 95.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.453 -179.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . 0.636 ' NH2' ' CG ' ' A' ' 290' ' ' HIS . 5.5 mmp_? -64.12 -37.74 88.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.06 0.457 . . . . 0.0 110.677 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . 0.451 ' OE1' ' O ' ' A' ' 284' ' ' SER . 0.4 OUTLIER -60.22 -56.38 22.21 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.324 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.447 ' HD3' HD23 ' A' ' 292' ' ' LEU . 28.3 mmtt -65.57 -34.94 79.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.979 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . 0.636 ' CG ' ' NH2' ' A' ' 287' ' ' ARG . 42.8 t-80 -51.84 -48.68 63.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.66 -37.01 79.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.541 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.447 HD23 ' HD3' ' A' ' 289' ' ' LYS . 14.6 tp -62.2 -49.93 73.79 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.555 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . 0.463 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.4 mp -62.91 -41.33 99.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.134 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.891 ' OE1' HD21 ' A' ' 264' ' ' LEU . 29.5 tp10 -62.99 -41.25 99.52 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -59.51 -48.22 87.08 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.15 -40.23 89.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 0.0 110.231 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.495 HG22 ' NE2' ' A' ' 257' ' ' HIS . 0.2 OUTLIER -56.84 -47.48 80.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.105 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -63.12 -42.41 99.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.452 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.73 -47.55 76.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.479 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . 0.422 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.5 OUTLIER -60.24 -43.44 96.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.512 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.82 -42.02 84.8 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . 0.602 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 53.5 t80 -62.66 -46.62 87.34 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.422 0.629 . . . . 0.0 110.587 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . 0.417 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 15.7 m -61.69 -45.93 91.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.454 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.51 -30.74 50.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.203 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -62.6 -55.04 30.87 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 121.141 0.496 . . . . 0.0 110.516 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . 0.602 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 77.5 mttt -62.17 -42.67 99.49 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.81 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.417 ' ND1' ' O ' ' A' ' 303' ' ' THR . 60.2 m80 -63.9 -32.01 73.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.988 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.425 HD23 ' CH2' ' A' ' 227' ' ' TRP . 1.6 mt -62.75 -48.44 79.19 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -66.84 -41.1 87.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.697 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -62.08 -49.12 77.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.793 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.453 ' HA ' HD23 ' A' ' 311' ' ' LEU . 26.6 mt -63.51 -40.58 97.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.029 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 6.7 t -60.02 -44.31 94.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.29 -44.86 84.31 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . 0.705 ' N ' ' HE ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -65.84 -43.61 87.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.877 0.37 . . . . 0.0 111.114 -179.599 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.3 mm -69.76 -24.02 26.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 67.7 m -59.14 -43.13 92.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.204 0.526 . . . . 0.0 110.057 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.251 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.755 0.312 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -61.19 -40.34 93.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 88.8 mmm -121.25 149.08 43.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.418 0.627 . . . . 0.0 111.074 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 23' ' ' GLU . 4.2 pm0 -61.58 -40.33 94.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.435 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -52.31 -48.79 65.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.179 0.514 . . . . 0.0 110.668 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.81 -39.47 91.87 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.359 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.9 t-20 -62.91 -38.82 92.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.189 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -61.74 -43.52 98.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.354 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.29 -42.68 99.06 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -61.16 -47.14 87.56 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.234 0.54 . . . . 0.0 110.44 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -57.51 -41.99 81.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -61.23 -43.1 99.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.238 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.87 88.11 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.071 0.462 . . . . 0.0 110.082 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.646 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 24.5 mt-30 -59.41 -39.31 83.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.173 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.603 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 61.6 ttt85 -60.96 -39.88 91.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.373 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.67 -34.53 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.296 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.646 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 24.9 m80 66.41 118.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.5 mt -137.13 154.61 75.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.115 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 79.4 Cg_exo -41.74 154.62 0.09 OUTLIER 'Trans proline' 0 C--N 1.312 -1.354 0 C-N-CA 122.504 2.136 . . . . 0.0 112.41 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 34.1 Cg_exo -56.5 -47.49 23.69 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.511 2.141 . . . . 0.0 112.375 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.8 -45.71 94.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.447 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpt180 -62.52 -41.89 99.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.58 -43.61 98.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.715 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.26 89.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.595 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -68.67 -42.38 77.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.528 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.729 HD13 ' OH ' ' A' ' 88' ' ' TYR . 50.9 tp -63.04 -48.67 77.74 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.23 0.538 . . . . 0.0 110.661 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -59.96 -42.77 94.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.25 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.615 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.33 -46.56 88.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.607 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -55.8 -47.78 76.53 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.485 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.0 -40.74 85.82 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.139 0.495 . . . . 0.0 109.988 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.49 -39.14 82.77 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.947 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 47' ' ' ALA . 35.9 mm -62.83 -42.71 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.59 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -55.79 -46.79 77.89 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.444 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -60.06 -50.48 73.56 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.355 0.597 . . . . 0.0 110.419 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.313 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -61.21 -40.57 94.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.385 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.18 -51.02 67.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.05 -39.65 93.09 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.242 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.5 92.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.63 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.459 ' CZ3' ' HD3' ' A' ' 63' ' ' LYS . 89.3 t90 -61.87 -40.26 94.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.267 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.76 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 87.8 tttt -57.61 -49.33 76.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.463 0.649 . . . . 0.0 109.556 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -66.46 -41.27 89.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.182 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.46 -44.16 97.59 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.618 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.76 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 18.4 pttm -61.93 -39.19 91.19 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 63' ' ' LYS . 56.5 tp . . . . . 0 CA--C 1.522 -0.117 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.509 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.619 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -60.61 -35.03 75.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.796 0.331 . . . . 0.0 110.361 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -62.07 -48.32 80.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.23 0.538 . . . . 0.0 110.003 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.37 -39.32 90.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.252 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.41 94.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.208 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -63.66 -39.74 95.1 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.466 -0.493 . . . . 0.0 109.754 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.7 mt -62.62 -45.23 93.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.431 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.24 -44.58 95.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.056 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.755 ' O ' HG23 ' A' ' 83' ' ' VAL . 63.3 ttm-85 -58.1 -42.63 86.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.885 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.428 ' O ' HG13 ' A' ' 84' ' ' ILE . 11.5 m120 -62.72 -39.62 94.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.308 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.59 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -57.78 -49.63 75.96 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.96 -179.359 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.446 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 53.9 t-20 -64.68 -37.37 87.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.336 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 79' ' ' ARG . 72.7 t -63.16 -45.8 97.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.466 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.17 -50.34 80.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.061 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 3.6 mm? -65.44 -39.77 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.769 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.84 -45.23 95.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.65 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -62.83 -45.87 90.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.849 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.729 ' OH ' HD13 ' A' ' 45' ' ' LEU . 8.7 m-85 -64.44 -28.04 69.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.297 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.18 23.29 61.45 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.7 mt . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.8 0.333 . . . . 0.0 110.398 179.851 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.1 mt . . . . . 0 C--O 1.238 0.465 0 CA-C-O 121.234 0.54 . . . . 0.0 110.664 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.56 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 96.8 mt-10 -58.81 -33.18 70.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.333 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 56.6 mttp -60.8 -47.97 83.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.712 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.19 -45.82 86.65 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.206 0.527 . . . . 0.0 111.928 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.487 ' CE3' HD22 ' A' ' 135' ' ' LEU . 14.3 t-105 -60.86 -51.5 69.05 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.975 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.56 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.7 m-70 -68.88 -29.32 67.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.234 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.634 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.1 tptt -57.6 -49.97 74.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.452 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.404 ' HB1' ' CB ' ' A' ' 130' ' ' PHE . . . -71.68 -47.56 53.33 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 119.3 -0.96 . . . . 0.0 111.022 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.427 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 38.3 ttmt -53.21 -48.47 68.1 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.875 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 10.5 m -78.91 -43.28 25.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.897 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.585 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 18.0 m -44.73 -28.49 0.63 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -163.87 -96.03 0.11 Allowed Glycine 0 C--N 1.321 -0.259 0 C-N-CA 119.684 -1.246 . . . . 0.0 111.576 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.702 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -152.02 20.5 0.68 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.46 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 2.6 m-85 -59.53 41.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.613 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.798 ' HA ' HD12 ' A' ' 135' ' ' LEU . 5.5 p -103.0 114.46 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.976 0.417 . . . . 0.0 111.247 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.502 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 120.92 -96.88 0.61 Allowed Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.788 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.47 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 79.7 mm-40 -72.97 -43.77 61.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.909 0.385 . . . . 0.0 111.342 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 4.1 mp0 -65.52 -45.8 82.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.126 0.489 . . . . 0.0 110.165 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 131' ' ' SER . 1.7 mt -60.64 -41.9 95.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.898 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.502 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -63.01 -40.23 97.15 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.92 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -59.56 -44.36 93.3 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 121.273 0.558 . . . . 0.0 110.207 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.1 mm? -60.84 -42.52 97.94 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -30.67 70.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 176.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 136' ' ' ASP . 59.6 mmt-85 -59.02 -44.16 91.69 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.432 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -71.02 -39.44 72.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.859 179.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.27 -58.28 9.2 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.565 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 143' ' ' LEU . 93.9 mt -61.0 -39.29 89.12 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.218 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -55.25 -43.02 74.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.441 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.662 ' CE1' HG23 ' A' ' 197' ' ' ILE . 7.7 m-70 -64.84 -38.23 90.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -59.64 -45.03 93.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.403 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -70.48 -51.74 26.91 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.739 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.442 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 14.5 mptt -62.54 -44.51 96.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.157 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 2.6 p -63.77 -35.95 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.501 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.776 ' O ' HG23 ' A' ' 154' ' ' VAL . 1.9 m170 -66.01 -43.23 88.32 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.665 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.99 -44.7 96.18 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.364 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.442 ' CD2' ' O ' ' A' ' 148' ' ' LYS . 31.4 m-85 -69.58 -46.76 65.61 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.904 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -65.59 -41.07 93.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.103 0.478 . . . . 0.0 110.527 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 150' ' ' HIS . 63.8 t -63.08 -43.92 99.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.674 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 44.7 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.561 179.64 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 193' ' ' LYS . 75.7 mm-40 . . . . . 0 CA--C 1.518 -0.268 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.543 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 21.1 mt -61.16 -41.62 97.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.932 0.396 . . . . 0.0 110.208 178.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.652 ' HA ' HD23 ' A' ' 194' ' ' LEU . 68.1 mttm -67.68 -35.92 79.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.815 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 79.8 mm-40 -67.06 -45.65 76.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.981 0.42 . . . . 0.0 111.492 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.543 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 4.5 ptmt -69.25 -36.54 77.25 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.936 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.826 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -62.53 -44.11 97.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.989 -179.521 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.533 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 16.0 ptm180 -65.78 -35.87 81.93 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.417 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.44 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 72.4 m -59.5 -40.56 87.43 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.662 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.6 mt -63.76 -42.98 97.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.399 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -58.84 -41.99 88.24 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.61 -38.54 88.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.33 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.55 -41.68 97.36 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.213 -1.155 . . . . 0.0 110.213 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 204' ' ' LEU . 20.4 mt -61.94 -40.14 94.5 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.672 178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -62.04 -36.53 81.87 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.464 ' O ' ' HD3' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -62.45 -42.49 99.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.248 178.832 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 201' ' ' LEU . 32.4 mt -60.19 -39.36 86.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.451 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -60.44 -41.8 94.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.604 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.603 ' O ' ' N ' ' A' ' 210' ' ' GLN . 25.9 mmt85 -62.43 -38.62 90.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.117 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.591 ' O ' ' N ' ' A' ' 211' ' ' GLY . 30.4 t -63.64 -45.09 98.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.302 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -66.13 -28.17 68.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.471 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -94.64 -39.45 10.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.026 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.603 ' N ' ' O ' ' A' ' 206' ' ' ARG . 56.2 tt0 -96.16 -40.46 9.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.399 . . . . 0.0 110.715 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.434 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.43 ' O ' ' O ' ' A' ' 220' ' ' GLU . 96.9 mt-10 . . . . . 0 N--CA 1.454 -0.247 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.623 ' C ' ' H ' ' A' ' 222' ' ' ARG . 7.3 mt-10 41.12 103.69 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.264 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.486 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 32.1 Cg_exo -57.97 15.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 123.023 2.482 . . . . 0.0 112.243 177.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.623 ' H ' ' C ' ' A' ' 220' ' ' GLU . 84.8 mtt85 -112.66 -59.81 1.96 Allowed 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.853 0.359 . . . . 0.0 110.692 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.899 HG13 ' H ' ' A' ' 224' ' ' ILE . 6.2 p -65.37 -64.61 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-O 121.404 0.621 . . . . 0.0 111.326 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.899 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -62.3 -32.39 54.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.721 -179.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 21.8 t70 -63.0 -40.74 98.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.303 0.573 . . . . 0.0 109.836 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.8 mt -61.42 -40.78 95.66 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.572 ' CH2' HD23 ' A' ' 308' ' ' LEU . 40.0 m0 -59.75 -38.28 81.33 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.059 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -63.22 -37.55 87.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.443 ' HA ' HD23 ' A' ' 229' ' ' LEU . 93.3 mt -63.96 -41.86 97.45 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.366 0.603 . . . . 0.0 110.199 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -50.03 -14.88 0.17 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.835 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.578 ' O ' HD21 ' A' ' 240' ' ' LEU . 18.3 pt20 -64.82 -42.83 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.759 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.5 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 23.7 m -136.95 58.03 1.74 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -109.28 45.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.403 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . 0.578 ' C ' HD22 ' A' ' 235' ' ' LEU . 50.2 t-20 65.84 53.38 1.15 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.998 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.578 HD22 ' C ' ' A' ' 234' ' ' ASN . 4.2 mm? -108.56 177.87 4.66 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.066 0.46 . . . . 0.0 110.447 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.477 ' OG1' ' CG ' ' A' ' 239' ' ' GLU . 60.6 p -84.57 -176.23 6.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.477 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -85.47 -50.78 7.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.202 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -62.01 -44.72 96.12 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.033 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . 0.477 ' CG ' ' OG1' ' A' ' 236' ' ' THR . 85.8 mt-10 -61.87 -34.28 75.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.578 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -64.77 -42.08 95.39 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.837 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -64.3 -49.09 73.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.512 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.42 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.126 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.3 -43.25 95.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.456 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -56.43 -51.28 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 110.381 -178.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -66.54 -39.95 88.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.744 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -58.89 -53.99 52.13 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.207 0.527 . . . . 0.0 110.447 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 247' ' ' LEU . 4.5 mm? -64.08 -33.81 76.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.444 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.716 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.9 tttt -57.28 -44.96 84.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.224 0.535 . . . . 0.0 110.072 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -68.96 -44.04 73.77 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.604 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -61.24 -47.2 87.15 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 120.991 0.424 . . . . 0.0 111.088 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.716 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.0 OUTLIER -61.28 -36.27 79.58 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.72 87.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.69 -48.16 80.5 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.233 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.401 HG22 ' H ' ' A' ' 254' ' ' ILE . 1.2 tt -65.02 -34.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.096 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -64.57 -44.73 89.8 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.34 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.82 -44.31 96.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.332 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -44.8 73.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -60.71 -40.76 93.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.29 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -59.78 -47.22 86.57 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.515 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -63.94 -34.52 78.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.397 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.591 HE21 ' CG2' ' A' ' 297' ' ' THR . 72.5 mm-40 -61.8 -46.87 87.66 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.189 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.99 -46.76 87.83 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.05 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -64.38 -34.96 79.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.987 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 60.5 tp -62.62 -42.9 99.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -64.81 -44.66 89.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.712 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.42 -43.26 98.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.192 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.4 -38.6 87.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.099 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -61.54 -46.79 88.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.87 -49.12 78.93 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -61.89 -38.75 89.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.516 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.04 -43.06 99.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.261 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -60.27 -43.27 96.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.403 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -65.9 -39.88 91.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.29 -38.32 89.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.941 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -63.9 -30.37 71.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.517 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 6.4 t -59.39 -40.16 85.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.536 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 91.5 t -60.75 -45.31 97.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.495 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 86.35 18.72 58.45 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.03 -38.24 90.36 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.292 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 81.47 -164.76 45.73 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 63.27 -70.58 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.8 0.333 . . . . 0.0 110.619 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 280' ' ' GLY . 11.2 ptp85 -67.97 -24.56 65.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.825 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.9 -47.59 92.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.421 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 38.6 t -66.55 -44.86 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.18 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.03 -49.49 77.19 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.876 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 71.7 m -60.83 -43.96 97.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -63.63 -39.06 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.724 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -58.36 -57.18 14.02 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.95 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.686 ' HD3' HD23 ' A' ' 292' ' ' LEU . 17.1 mmtm -64.28 -36.49 84.27 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.077 179.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -49.23 -50.05 40.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.78 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.4 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.601 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.686 HD23 ' HD3' ' A' ' 289' ' ' LYS . 22.8 tp -59.98 -49.72 76.58 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.548 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.17 -42.07 99.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.014 0.435 . . . . 0.0 109.891 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.59 ' O ' ' OG1' ' A' ' 297' ' ' THR . 12.3 tm-20 -60.97 -40.12 92.2 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.04 -43.22 99.46 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.26 -43.95 98.04 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.227 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.591 ' CG2' HE21 ' A' ' 261' ' ' GLN . 25.3 p -57.36 -43.86 83.87 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.99 0.424 . . . . 0.0 110.121 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -62.79 -46.36 88.36 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.137 0.494 . . . . 0.0 110.681 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.52 -39.92 89.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.144 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.85 -43.86 98.0 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.152 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.72 -42.55 96.42 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -61.52 -44.89 96.25 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.137 0.494 . . . . 0.0 110.616 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.3 m -60.52 -43.93 96.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.352 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.8 t -59.81 -42.76 90.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.921 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.71 -50.51 72.97 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.031 0.443 . . . . 0.0 110.596 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -63.77 -41.18 98.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.682 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -66.23 -34.98 79.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.011 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.664 HD22 HG21 ' A' ' 223' ' ' VAL . 19.3 mt -62.14 -43.72 98.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.378 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -68.53 -43.87 75.83 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.737 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -64.15 -49.53 71.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.112 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 311' ' ' LEU . 28.1 mt -63.89 -41.32 97.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.9 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 74.7 m -59.64 -41.81 91.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.545 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -68.4 -47.47 57.49 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -66.1 -42.35 89.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.785 0.326 . . . . 0.0 111.269 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -70.23 -23.75 25.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.94 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.4 t -59.66 -43.84 93.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 109.735 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.732 179.392 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 . . . . . 0 N--CA 1.462 0.131 0 CA-C-O 120.758 0.313 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.489 ' C ' ' SD ' ' A' ' 22' ' ' MET . 85.5 mtp180 -92.38 -4.08 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.78 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.538 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -133.56 137.98 45.8 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.027 0.441 . . . . 0.0 111.109 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 16.6 pt-20 -65.12 -42.59 93.77 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' H ' ' HG2' ' A' ' 24' ' ' LYS . 13.2 pttm -57.0 -45.42 83.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.0 0.429 . . . . 0.0 109.963 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.1 mp -61.62 -41.51 97.58 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.1 m-80 -62.09 -38.75 90.03 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.199 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -59.01 -48.78 80.36 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.885 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.436 ' N ' HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -61.97 -42.14 98.79 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.116 179.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.645 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 61.1 t-105 -61.12 -45.06 96.23 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.072 0.463 . . . . 0.0 110.383 179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.439 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 81.3 tt0 -56.85 -46.04 82.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.372 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -61.71 -40.56 95.48 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.474 -0.491 . . . . 0.0 110.281 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.91 -43.9 86.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.645 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 88.2 mt-30 -62.81 -38.5 90.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.232 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.439 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -61.19 -41.66 97.21 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.376 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.17 -41.17 97.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.337 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.401 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.2 OUTLIER 65.33 104.83 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.764 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.522 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -125.47 158.51 64.2 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.354 179.614 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -39.12 153.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.478 0 C-N-CA 122.593 2.195 . . . . 0.0 112.417 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.5 -41.77 68.25 Favored 'Trans proline' 0 N--CA 1.499 1.837 0 C-N-CA 122.812 2.341 . . . . 0.0 112.538 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 70.6 t -62.69 -46.42 96.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -64.76 -38.52 91.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.335 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.25 -46.08 88.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.18 -42.67 83.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.866 0.365 . . . . 0.0 110.816 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -67.63 -45.27 75.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.564 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.52 HD13 ' OH ' ' A' ' 88' ' ' TYR . 59.3 tp -63.13 -48.89 76.57 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.523 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -60.3 -41.31 93.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.282 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.583 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.97 -50.41 74.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -57.65 -48.11 80.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.946 0.403 . . . . 0.0 110.996 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.71 -39.82 81.91 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.01 -40.46 89.34 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.882 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.583 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.6 mm -62.45 -43.84 98.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -58.42 -42.89 88.28 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.684 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.49 -49.56 77.05 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.155 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -63.0 -41.57 99.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.792 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 55' ' ' ASP . 48.5 t0 -63.34 -39.38 94.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.356 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.33 -46.38 90.51 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.848 0.356 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.6 tp -61.4 -43.52 98.73 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.722 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.411 ' O ' HD13 ' A' ' 62' ' ' LEU . . . -61.98 -44.5 96.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.696 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.3 t90 -56.33 -42.45 77.7 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.2 tttt -60.52 -45.92 92.03 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.688 -0.405 . . . . 0.0 109.977 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -60.47 -42.64 96.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.265 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 58' ' ' ALA . 10.3 mp -62.03 -40.64 96.4 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.341 -0.544 . . . . 0.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.96 -40.72 85.6 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.642 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.5 tt . . . . . 0 C--N 1.328 -0.332 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.76 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -66.81 -34.39 77.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.453 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.491 ' HD2' ' H ' ' A' ' 73' ' ' LYS . 2.7 mptp? -61.44 -68.09 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.074 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -51.74 -39.14 57.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.367 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.53 95.11 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.412 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.487 ' NH1' HD21 ' A' ' 80' ' ' ASN . 73.7 ttt-85 -62.62 -43.07 99.73 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.01 -43.37 98.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.573 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.58 -44.69 98.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.148 0.499 . . . . 0.0 109.95 179.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.553 ' O ' HG23 ' A' ' 83' ' ' VAL . 7.9 mmp_? -59.86 -41.74 92.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.236 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.487 HD21 ' NH1' ' A' ' 76' ' ' ARG . 92.1 m-20 -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.532 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.579 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.22 -49.19 78.79 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.753 -179.55 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.422 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 50.8 t-20 -64.21 -40.44 96.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.678 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 79' ' ' ARG . 55.6 t -62.0 -45.81 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.773 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.65 -48.85 86.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.318 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.5 -38.56 90.08 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.76 77.27 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.319 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.73 -46.1 83.67 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.288 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.52 ' OH ' HD13 ' A' ' 45' ' ' LEU . 12.8 m-85 -63.85 -27.7 69.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.946 0.403 . . . . 0.0 110.121 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.38 29.37 73.08 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.3 mt . . . . . 0 C--N 1.332 -0.157 0 CA-C-O 120.878 0.37 . . . . 0.0 110.798 -179.728 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 58.2 mt . . . . . 0 C--O 1.234 0.251 0 CA-C-O 120.882 0.372 . . . . 0.0 110.644 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 77.9 mt-10 -60.48 -25.2 65.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.937 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.49 -55.76 29.53 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.52 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 120' ' ' LEU . 32.1 mt -68.96 -42.33 76.76 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 112.112 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.64 ' CE3' HD22 ' A' ' 135' ' ' LEU . 7.5 t-105 -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.739 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.593 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.4 m-70 -68.0 -32.92 73.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.054 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.464 ' O ' ' CB ' ' A' ' 127' ' ' SER . 13.1 tptt -57.52 -49.56 75.93 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.96 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -69.15 -47.41 65.09 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.654 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.455 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 37.3 ttmt -54.6 -50.72 67.38 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.649 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 54.7 m -74.31 -41.9 60.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.932 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.3 t -48.62 -26.15 2.11 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 -178.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.67 -94.22 0.1 OUTLIER Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.041 -1.076 . . . . 0.0 111.515 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.4 pttm -162.83 30.97 0.1 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.515 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 6.5 m-85 -64.31 49.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.233 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.576 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.6 p -104.5 137.4 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.197 0.522 . . . . 0.0 111.767 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 95.45 -97.34 2.1 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-N 115.234 -0.893 . . . . 0.0 112.218 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 97.9 mt-10 -78.14 -43.91 27.49 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.8 0.333 . . . . 0.0 111.679 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 138' ' ' LEU . 48.2 mt-10 -60.61 -52.52 64.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.054 0.454 . . . . 0.0 110.197 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.64 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -62.05 -41.44 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.938 179.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -61.3 -37.97 85.15 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 56.1 mmtt -62.03 -42.41 99.15 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 134' ' ' GLU . 9.1 mp -59.73 -42.56 93.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -36.94 85.96 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.569 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 72.5 mtp85 -54.1 -42.13 69.06 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 118.588 -1.245 . . . . 0.0 108.149 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -69.23 -41.62 76.76 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.678 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -57.23 -57.57 12.02 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.583 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.56 -39.14 83.05 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.179 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.569 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 44.9 m170 -54.61 -43.16 71.96 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.416 -0.514 . . . . 0.0 109.846 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.62 -39.13 88.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.574 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -59.75 -46.3 89.57 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.192 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 10.2 pt-20 -69.89 -44.82 68.97 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.419 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 86.1 mttt -62.92 -46.7 86.58 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.233 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.444 HG22 HD13 ' A' ' 197' ' ' ILE . 55.1 t -64.49 -44.27 96.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.397 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.733 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.4 m170 -60.87 -38.54 85.98 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.465 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -61.49 -44.75 96.53 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.992 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.557 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 31.3 m-85 -66.74 -49.67 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.381 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -65.66 -41.03 93.01 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.953 0.406 . . . . 0.0 111.164 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 150' ' ' HIS . 66.9 t -63.57 -44.54 98.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.727 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.2 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.511 179.373 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 . . . . . 0 C--O 1.23 0.07 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 3.4 mt -62.17 -39.79 93.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.156 179.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -66.64 -42.47 86.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.007 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -68.69 -35.79 77.66 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.567 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.557 ' HE3' ' CD1' ' A' ' 152' ' ' TYR . 26.9 mtpt -63.34 -46.95 84.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.696 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -72.24 -35.77 68.91 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.286 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.451 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 11.0 mmt85 -64.29 -41.36 96.91 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.626 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 69.8 m -65.47 -45.22 84.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.229 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.444 HD13 HG22 ' A' ' 149' ' ' VAL . 90.7 mt -66.33 -44.31 91.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.176 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -65.73 -40.83 92.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.029 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 195' ' ' ARG . 79.3 mt-30 -64.32 -36.68 84.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.23 178.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.98 -51.83 50.04 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 31.0 mt -64.29 -41.63 96.78 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.222 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -63.58 -36.6 84.34 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.71 ' HE ' HG21 ' A' ' 207' ' ' VAL . 0.0 OUTLIER -63.16 -44.16 96.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.72 179.101 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 33.3 mt -62.02 -39.03 90.91 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -61.93 -45.6 92.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.968 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.69 ' O ' ' N ' ' A' ' 210' ' ' GLN . 90.3 mmt-85 -65.76 -42.35 90.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.092 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.71 HG21 ' HE ' ' A' ' 203' ' ' ARG . 77.0 t -64.09 -45.36 96.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.061 0.457 . . . . 0.0 110.319 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -67.47 -28.85 68.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.659 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -101.21 -14.11 17.84 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.712 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.69 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.1 tt0 -140.15 -20.32 0.87 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.619 0.247 . . . . 0.0 111.361 -179.031 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.682 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 N--CA 1.461 0.339 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 220' ' ' GLU . 82.0 tt0 . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 219' ' ' GLU . 2.8 mt-10 55.36 153.59 0.06 OUTLIER Pre-proline 0 N--CA 1.472 0.64 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.675 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -83.12 81.79 2.28 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 122.201 1.934 . . . . 0.0 112.07 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -147.28 -98.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.968 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.552 HG13 ' N ' ' A' ' 224' ' ' ILE . 7.5 p -60.52 -46.04 96.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.659 0 CA-C-O 121.154 0.502 . . . . 0.0 110.801 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.754 HD11 ' CE1' ' A' ' 250' ' ' PHE . 0.7 OUTLIER -63.41 -35.64 73.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.818 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -62.09 -41.87 98.63 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.067 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 9.6 mt -59.39 -40.58 87.01 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.614 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 46.6 m0 -60.48 -43.98 96.39 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.04 178.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.624 HD23 ' OG ' ' A' ' 232' ' ' SER . 3.6 mt -68.9 -43.82 74.45 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.331 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -39.64 -37.68 0.53 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.396 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -70.17 -45.87 65.84 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.173 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.624 ' OG ' HD23 ' A' ' 229' ' ' LEU . 91.6 p -80.11 -6.88 58.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.394 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -67.26 -121.28 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.376 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . 0.521 ' C ' HD22 ' A' ' 235' ' ' LEU . 0.2 OUTLIER -163.38 69.58 0.22 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 110.544 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 235' ' ' LEU . 3.4 mm? -100.76 -171.91 2.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.711 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 10.9 p -82.97 163.15 21.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.699 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -63.79 -46.89 83.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.892 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.51 -43.13 95.06 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.556 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -63.74 -36.29 83.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.084 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.638 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.2 OUTLIER -61.79 -45.31 94.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.384 -179.615 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -64.24 -47.49 79.46 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.89 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.56 -41.98 99.25 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.816 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.498 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.23 -43.95 93.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.437 178.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -47.5 85.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.211 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.91 -46.97 79.45 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.354 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -56.44 -53.13 61.0 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.292 0.568 . . . . 0.0 110.382 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.03 -40.3 97.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.573 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 64.1 tttp -50.47 -45.46 56.21 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.76 -41.83 91.6 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.221 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . 0.754 ' CE1' HD11 ' A' ' 224' ' ' ILE . 0.0 OUTLIER -58.64 -51.45 69.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.447 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.551 ' N ' ' CG ' ' A' ' 250' ' ' PHE . 11.6 pt-20 -59.59 -37.5 78.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.04 95.77 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.525 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.3 -46.22 87.73 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.41 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -64.64 -38.7 83.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -60.34 -44.91 95.09 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.515 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -61.63 -43.91 97.98 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . 0.532 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -55.95 -43.97 77.99 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.539 -0.464 . . . . 0.0 109.78 179.226 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . 0.532 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 39.9 t-20 -59.92 -41.16 91.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.237 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -59.0 -47.95 83.37 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.905 0.384 . . . . 0.0 110.296 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -61.8 -37.59 84.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.303 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.429 HE21 ' HB ' ' A' ' 297' ' ' THR . 62.1 mm-40 -59.16 -43.84 92.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.307 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -61.61 -47.76 83.98 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.13 0.49 . . . . 0.0 110.041 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -64.27 -35.06 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.03 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 65.3 tp -62.04 -42.99 99.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.201 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.21 -46.2 88.11 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.456 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.13 -43.63 98.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.164 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.55 78.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.251 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . 0.53 ' NE2' ' NE ' ' A' ' 272' ' ' ARG . 24.7 t60 -64.05 -46.1 85.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.318 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.95 -46.15 91.86 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 110.389 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.47 -39.41 90.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.356 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.697 ' O ' HD23 ' A' ' 271' ' ' LEU . 2.6 tt -60.42 -44.59 95.61 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . 0.53 ' NE ' ' NE2' ' A' ' 268' ' ' HIS . 99.8 mtt180 -60.33 -44.17 95.75 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.21 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -67.77 -39.62 84.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.656 -0.417 . . . . 0.0 110.83 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.557 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -60.59 -36.81 79.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.007 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.61 -24.5 63.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 0.0 110.364 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 9.0 t -88.32 3.46 49.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.868 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.592 HG13 ' N ' ' A' ' 278' ' ' GLY . 11.3 p -61.11 -44.94 99.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.592 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 149.41 -98.44 0.19 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.72 -37.95 89.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.833 0.349 . . . . 0.0 110.164 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.14 46.75 8.93 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -68.72 -32.77 72.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.741 0.305 . . . . 0.0 110.755 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . 0.441 HH11 ' CB ' ' A' ' 274' ' ' ALA . 9.4 ptm180 -91.07 0.96 57.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.995 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 39.2 t -61.49 -46.33 96.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.7 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.5 t -61.74 -44.78 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.139 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 53.1 ttt85 -62.68 -46.8 86.48 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.952 0.406 . . . . 0.0 110.924 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.1 t -63.22 -45.07 93.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -63.9 -39.79 94.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -58.76 -59.58 5.2 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.019 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.602 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.7 mmtp -64.02 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.866 -0.734 . . . . 0.0 110.044 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -46.19 -54.65 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.897 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.34 82.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.714 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.602 HD23 ' HD3' ' A' ' 289' ' ' LYS . 18.5 tp -59.77 -49.92 75.85 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.809 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.65 -42.0 98.16 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.38 0.61 . . . . 0.0 109.827 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.484 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.9 tt0 -62.91 -36.62 83.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.802 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.96 -42.86 98.13 Favored Glycine 0 CA--C 1.522 0.492 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.2 tpp85 -60.33 -44.47 95.47 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.08 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 35.2 p -58.87 -46.76 87.01 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.436 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -62.5 -45.07 94.7 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.05 0.453 . . . . 0.0 110.338 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -59.5 -39.99 85.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.71 -43.01 99.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.17 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.22 -42.15 97.09 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 61.5 t80 -61.93 -45.53 93.28 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.389 0.614 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 9.8 m -59.75 -42.58 93.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.763 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.74 -42.91 90.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -54.9 -52.17 63.75 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.571 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 50.1 mttt -62.46 -40.5 96.82 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.93 -0.708 . . . . 0.0 110.996 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -64.46 -36.32 83.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.188 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.614 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 12.4 mt -62.51 -43.74 98.08 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.448 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -66.94 -44.72 79.91 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.672 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -64.41 -48.55 74.97 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.405 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.459 HD12 ' CH2' ' A' ' 227' ' ' TRP . 31.8 mt -63.29 -41.73 99.01 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.523 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 11.5 t -61.0 -43.33 99.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.446 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.21 -51.8 52.23 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 120.931 -0.652 . . . . 0.0 111.682 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -67.2 -41.85 85.12 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.218 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 5.0 mm -63.76 -41.73 93.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.1 p -58.88 -41.22 86.61 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.502 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.4 tpp180 . . . . . 0 N--CA 1.449 -0.523 0 C-N-CA 117.814 -1.555 . . . . 0.0 108.146 176.81 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 . . . . . 0 N--CA 1.462 0.156 0 CA-C-O 120.685 0.279 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.679 ' NH2' ' OE2' ' A' ' 53' ' ' GLU . 89.3 mtm-85 -95.85 12.37 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.018 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.448 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 1.2 mpt? -138.03 141.39 40.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.035 0.445 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 20.2 pt-20 -65.48 -43.72 89.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.424 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 14.0 pttm -55.66 -44.62 77.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.2 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 22' ' ' MET . 95.7 mt -62.85 -42.38 99.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.025 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -62.93 -41.69 99.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.377 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -60.02 -45.42 92.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.572 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 28' ' ' LEU . 92.4 mt -61.89 -42.57 99.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.254 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 27.7 t-105 -62.58 -45.96 90.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.384 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -57.54 -43.49 84.45 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.252 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.24 -43.05 99.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.591 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.09 80.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.942 0.401 . . . . 0.0 110.342 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.635 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 76.3 mt-30 -61.65 -38.66 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.349 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.536 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 60.1 ttm-85 -60.57 -42.16 96.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.384 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.0 mt -69.55 -30.15 67.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.732 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.635 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 24.7 m80 65.99 118.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.743 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -138.07 154.46 74.21 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.859 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.31 154.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 122.718 2.279 . . . . 0.0 112.364 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.67 -48.7 0.38 Allowed 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.617 2.211 . . . . 0.0 112.403 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.543 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 71.7 t -61.67 -48.65 87.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.435 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.7 ttp85 -65.04 -41.67 94.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.402 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.47 -42.4 99.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.619 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.82 88.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.414 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.543 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 3.7 mp0 -67.91 -41.22 83.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.652 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.7 tp -61.84 -48.33 81.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.154 0.502 . . . . 0.0 110.622 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.2 -41.44 96.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.604 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -57.92 -48.61 79.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.603 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -55.75 -48.97 74.34 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.94 0.4 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.9 mt -58.25 -39.78 80.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.153 0.501 . . . . 0.0 109.833 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.81 -38.42 85.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.604 HG12 ' O ' ' A' ' 47' ' ' ALA . 37.2 mm -62.3 -42.57 95.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.671 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -57.38 -50.85 71.67 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.471 179.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.679 ' OE2' ' NH2' ' A' ' 21' ' ' ARG . 82.2 tt0 -55.24 -49.25 72.49 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.444 0.64 . . . . 0.0 110.296 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -60.73 -42.74 97.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.314 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -62.02 -38.24 87.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.4 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.45 -49.23 76.93 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.89 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 14.8 mt -61.32 -42.25 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.456 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -41.78 97.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.49 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -60.67 -41.42 95.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.291 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -58.88 -46.01 88.84 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -59.53 -43.29 93.5 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.85 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.05 -37.51 87.47 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.009 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -57.55 -45.6 84.92 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.867 179.142 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.527 0.805 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -70.28 -35.27 73.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.856 0.36 . . . . 0.0 110.332 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -64.75 -52.28 57.81 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.129 0.49 . . . . 0.0 110.583 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 22.4 pt-20 -62.65 -38.94 92.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.979 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.47 -42.31 91.73 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.323 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.8 ttt-85 -63.64 -43.52 96.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -63.73 -42.98 97.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.366 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.82 -44.47 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.192 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.604 ' O ' HG23 ' A' ' 83' ' ' VAL . 3.3 mmp_? -59.83 -42.03 92.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.256 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 84' ' ' ILE . 92.6 m-20 -63.57 -39.85 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.294 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.637 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.83 -48.15 82.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.277 0.561 . . . . 0.0 110.171 -179.491 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.77 -38.16 88.3 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.412 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 79' ' ' ARG . 53.6 t -63.71 -46.24 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.424 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.9 mt -59.67 -51.32 74.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.473 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.31 -42.47 92.99 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.062 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.51 99.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.809 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -62.83 -49.22 75.76 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.564 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -67.6 -27.76 67.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.032 179.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 72.97 25.51 73.53 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 90' ' ' LEU . 50.0 mt . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.248 . . . . 0.0 110.75 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.235 0.339 0 CA-C-O 121.013 0.435 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.554 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 95.7 mt-10 -61.6 -39.41 91.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.573 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.6 mtmt -61.06 -42.4 98.42 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.409 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.49 -48.02 79.37 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.273 0.559 . . . . 0.0 111.88 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.558 ' CE3' HD22 ' A' ' 135' ' ' LEU . 19.1 t-105 -61.98 -48.42 80.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.426 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.554 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.6 m-70 -69.26 -29.92 67.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.335 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.626 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.5 tptt -58.58 -52.01 67.48 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.894 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.26 -46.46 49.82 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.433 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 46.4 tttt -52.0 -47.43 64.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.669 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.2 m -82.87 -43.98 15.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.863 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.567 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 20.6 m -44.53 -28.92 0.64 Allowed 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.155 -178.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -158.29 -96.84 0.12 Allowed Glycine 0 N--CA 1.46 0.284 0 C-N-CA 119.626 -1.273 . . . . 0.0 111.356 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.63 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.7 mttt -155.98 21.3 0.38 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.796 ' HA ' ' HG3' ' A' ' 134' ' ' GLU . 2.9 m-85 -62.45 49.44 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.907 -178.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.63 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.0 OUTLIER -112.39 110.77 21.17 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.378 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 133.31 -98.8 0.35 Allowed Glycine 0 CA--C 1.53 0.988 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.816 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.2 mm-40 -81.85 -44.05 17.41 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.495 -0.415 . . . . 0.0 111.31 -179.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.948 ' H ' ' CD ' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -63.73 -46.11 86.85 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.558 HD22 ' CE3' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -62.44 -41.9 99.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.097 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -62.98 -37.1 85.79 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.468 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 59.3 mttp -61.69 -43.11 99.49 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.324 0.583 . . . . 0.0 109.839 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 134' ' ' GLU . 2.7 mm? -59.47 -43.68 93.18 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.95 -37.38 87.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.619 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -51.38 -42.07 61.12 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.584 ' N ' ' OE1' ' A' ' 141' ' ' GLU . 6.0 mp0 -68.55 -45.47 72.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.374 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -56.6 -52.74 63.69 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.357 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.59 -39.94 89.94 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.238 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.8 m170 -55.5 -40.87 72.29 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.481 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.412 ' CE1' HG23 ' A' ' 197' ' ' ILE . 4.2 m-70 -64.97 -41.72 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.786 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -60.19 -48.89 79.81 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.763 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 18.5 pt-20 -70.93 -46.28 62.73 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.512 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 68.1 mttm -61.57 -43.2 99.3 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.542 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 43.4 t -64.65 -43.84 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.731 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.752 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -62.7 -36.18 82.13 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.452 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 147' ' ' GLU . 79.4 mm-40 -65.04 -48.04 75.25 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.55 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -67.96 -42.17 81.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.933 0.397 . . . . 0.0 110.432 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -69.45 -45.87 68.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.015 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.752 HG23 ' O ' ' A' ' 150' ' ' HIS . 71.6 t -62.71 -46.47 96.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.064 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 26.3 mt . . . . . 0 C--N 1.327 -0.41 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.575 179.645 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 . . . . . 0 CA--C 1.52 -0.208 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 10.6 mp -62.27 -45.08 94.87 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.597 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.487 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.11 -39.16 82.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.094 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 5.2 tm-20 -67.97 -46.05 72.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.084 0.469 . . . . 0.0 111.638 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 17.6 pttt -74.6 -44.5 50.39 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.325 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.695 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -67.15 -41.01 86.77 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.939 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.541 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -67.27 -35.58 79.79 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.62 ' O ' ' HG3' ' A' ' 199' ' ' GLN . 73.8 m -62.25 -40.74 97.18 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.412 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.5 mt -66.7 -44.26 89.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.357 0.599 . . . . 0.0 109.723 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -64.18 -47.46 79.74 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.436 0.636 . . . . 0.0 110.389 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.62 ' HG3' ' O ' ' A' ' 196' ' ' SER . 0.0 OUTLIER -64.58 -29.62 70.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.052 179.514 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -64.6 -43.56 96.29 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 201' ' ' LEU . 28.2 mt -63.6 -41.88 98.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.045 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.523 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.23 -36.21 83.35 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.368 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.4 -41.86 99.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.508 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.9 mt -61.43 -40.54 94.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.294 179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -63.45 -41.13 98.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.959 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.719 ' O ' ' N ' ' A' ' 210' ' ' GLN . 78.9 mtp85 -64.13 -38.94 92.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.288 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.588 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -64.17 -43.11 97.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.024 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.0 p -62.97 -37.31 86.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.683 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 24.1 m170 -94.61 -38.46 10.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.379 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.719 ' N ' ' O ' ' A' ' 206' ' ' ARG . 39.6 tt0 -93.89 -32.97 13.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.739 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.588 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.438 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 . . . . . 0 CA--C 1.53 0.185 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 221' ' ' PRO . 0.5 OUTLIER -59.31 178.67 0.22 Allowed Pre-proline 0 N--CA 1.466 0.353 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.619 -179.315 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 220' ' ' GLU . 59.3 Cg_endo -84.11 88.42 1.06 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.597 2.198 . . . . 0.0 112.801 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -141.25 -105.65 0.15 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.441 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.553 HG13 ' N ' ' A' ' 224' ' ' ILE . 14.9 p -61.74 -46.6 96.17 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 CA-C-O 121.79 0.805 . . . . 0.0 110.046 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.553 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.2 OUTLIER -61.56 -32.86 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.672 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . 0.551 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 56.1 t0 -64.25 -40.56 96.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.541 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.6 tp -56.04 -42.42 76.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.456 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 27.5 m0 -62.65 -33.92 76.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.736 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . 0.65 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 92.7 m-20 -59.31 -39.12 82.06 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.623 ' N ' HD22 ' A' ' 229' ' ' LEU . 4.1 mm? -65.67 -40.27 92.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.725 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.597 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -25.42 -66.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.301 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.65 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 0.3 OUTLIER -25.48 -87.48 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.726 179.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 58.9 m -79.26 45.95 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.738 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -139.51 81.59 1.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.835 0.35 . . . . 0.0 110.54 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 60.38 59.54 2.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.374 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.597 HD12 ' O ' ' A' ' 230' ' ' ALA . 76.8 mt -141.13 157.57 45.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.997 0.427 . . . . 0.0 110.783 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 74.8 p -83.34 -162.35 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.674 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 34.9 p-10 -91.75 -53.72 4.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.101 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 63.8 mttp -61.02 -45.59 94.18 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.25 0.547 . . . . 0.0 110.689 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -62.16 -27.17 68.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.556 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.1 OUTLIER -64.26 -46.1 85.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.589 -179.371 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -66.99 -44.05 81.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.363 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -57.96 -51.1 71.06 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.337 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.456 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.97 -45.02 95.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.51 179.424 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.4 ttt-85 -51.85 -57.53 9.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.403 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -62.08 -35.54 78.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.675 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.23 -53.02 63.02 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.23 0.538 . . . . 0.0 110.445 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.2 mm? -63.21 -41.42 99.14 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.728 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.56 -37.63 78.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.386 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -65.48 -65.01 0.73 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.493 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . 0.565 ' CE2' ' CE1' ' A' ' 307' ' ' HIS . 76.2 m-85 -60.46 -40.75 92.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.701 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.542 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.9 tp10 -57.9 -42.04 83.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.285 0.564 . . . . 0.0 109.883 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.33 -35.75 80.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.236 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -60.88 -47.63 85.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.834 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.46 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.2 tt -65.36 -38.13 81.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.174 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.79 -48.36 80.99 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 121.213 0.53 . . . . 0.0 110.468 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.03 -41.46 99.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.065 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . 0.523 ' NE2' ' CD ' ' A' ' 261' ' ' GLN . 0.0 OUTLIER -56.71 -46.16 81.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.955 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . 0.501 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 49.7 t30 -60.13 -40.99 91.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.24 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . 0.457 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -57.66 -45.08 86.02 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.258 0.552 . . . . 0.0 109.859 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.02 -37.01 85.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.292 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.523 ' CD ' ' NE2' ' A' ' 257' ' ' HIS . 82.2 mt-30 -58.23 -44.17 88.12 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.205 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.63 -47.25 86.25 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.115 0.483 . . . . 0.0 109.811 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . 0.457 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 5.5 mp0 -65.33 -31.89 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.021 179.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.04 -42.52 99.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.108 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 -65.99 -49.02 69.29 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.142 0.496 . . . . 0.0 110.474 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.62 -43.32 98.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.09 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.25 81.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.083 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -61.14 -48.41 81.76 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.25 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.93 -45.07 95.32 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.132 0.491 . . . . 0.0 110.398 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.15 -39.73 91.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.398 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.35 -43.75 96.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.037 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -60.31 -43.5 96.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.079 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -67.88 -40.76 83.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.826 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.33 86.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.948 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -55.84 -22.62 26.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.455 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 17.2 m -61.83 -39.06 90.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.65 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 77.9 t -60.85 -45.47 98.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.605 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 108.84 -6.79 33.14 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . 0.555 ' O ' HG23 ' A' ' 283' ' ' VAL . 91.4 m-20 -55.34 99.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.81 0.338 . . . . 0.0 110.496 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.7 -40.24 95.71 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.41 -46.32 89.14 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.729 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -68.94 -41.9 77.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.808 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 279' ' ' ASP . 54.6 t -64.35 -45.28 96.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 32.4 m -60.69 -45.86 92.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.058 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.86 -43.82 87.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.537 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 42.3 t -62.42 -43.66 98.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.585 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -64.26 -40.21 95.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.694 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -60.53 -51.49 69.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.162 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -66.02 -34.24 77.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.105 179.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -57.39 -52.05 66.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.601 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.67 -38.41 83.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.676 ' O ' HD12 ' A' ' 292' ' ' LEU . 2.2 tp -61.64 -46.91 87.76 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.237 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 297' ' ' THR . 41.9 tp -64.22 -42.85 96.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.202 0.525 . . . . 0.0 110.102 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.519 ' O ' ' OG1' ' A' ' 297' ' ' THR . 2.3 tm-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.79 -42.47 99.75 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -60.76 -43.54 97.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.473 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.519 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 76.7 p -58.97 -47.18 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.076 0.465 . . . . 0.0 110.358 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -62.35 -44.39 96.58 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.488 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -62.43 -37.5 86.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.022 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -44.18 97.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.983 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.51 96.28 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . 0.524 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 51.0 t80 -60.82 -45.83 92.93 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.245 0.545 . . . . 0.0 110.372 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.1 m -61.37 -44.75 96.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.461 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.96 -42.24 88.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.112 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.82 -54.92 40.89 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.058 0.456 . . . . 0.0 110.663 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . 0.524 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 75.4 mttt -61.22 -41.35 96.71 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.19 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.565 ' CE1' ' CE2' ' A' ' 250' ' ' PHE . 2.6 t-80 -64.76 -31.17 72.27 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.26 -48.35 81.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.178 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.62 -42.47 86.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.712 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.9 -47.21 85.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.47 HD11 ' CE1' ' A' ' 307' ' ' HIS . 26.8 mt -64.12 -40.51 96.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.74 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.1 t -59.7 -44.68 93.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.11 61.8 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -62.43 -45.6 92.37 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -70.34 -40.52 77.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.133 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.8 t -44.37 -48.08 9.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.055 0.455 . . . . 0.0 110.156 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 12.5 ptp85 . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.036 -178.037 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 . . . . . 0 N--CA 1.465 0.293 0 CA-C-O 120.755 0.312 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -89.61 10.99 21.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.971 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.3 mmm -142.89 141.39 31.51 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 111.062 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -63.86 -35.6 81.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.39 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -59.69 -47.96 83.56 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.017 0.437 . . . . 0.0 110.458 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.65 -37.88 88.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.47 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.43 ' OD1' ' O ' ' A' ' 26' ' ' ASN . 48.9 t-20 -63.32 -40.72 98.12 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.347 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.61 -44.27 96.73 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.604 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.91 -42.61 99.29 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.049 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -61.56 -43.66 98.45 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.222 0.534 . . . . 0.0 110.459 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -58.4 -44.52 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.047 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.52 -41.32 97.15 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.523 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.97 87.24 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.055 0.455 . . . . 0.0 110.224 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.42 -38.03 88.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.285 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -60.3 -43.15 96.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.313 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -65.0 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.227 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 66.27 112.13 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.817 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.1 mt -132.43 154.73 81.67 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.798 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -39.41 158.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.396 0 C-N-CA 122.768 2.312 . . . . 0.0 112.264 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -68.72 -46.57 1.7 Allowed 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 122.621 2.214 . . . . 0.0 112.3 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.96 -47.73 91.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.53 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -65.64 -39.2 91.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.349 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.85 -43.65 98.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.712 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -41.54 95.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.421 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -67.17 -45.19 77.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.98 -49.88 72.95 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.157 0.503 . . . . 0.0 110.641 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -60.96 -40.55 93.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.247 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.64 -40.66 92.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.374 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.07 -47.99 83.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.51 -40.31 96.34 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.543 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -58.29 -45.61 87.61 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.154 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -62.99 -42.61 97.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -51.89 -42.42 62.71 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -64.32 -44.52 91.3 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.783 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.426 ' O ' ' HD3' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -61.61 -44.76 96.4 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.44 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -61.27 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.483 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -57.79 -49.14 77.63 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.815 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -61.27 -42.27 98.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.334 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.53 -46.46 88.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.558 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.418 ' CH2' ' HD2' ' A' ' 63' ' ' LYS . 60.8 t90 -57.75 -40.6 80.09 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -58.74 -46.3 87.71 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.939 179.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -60.67 -44.63 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.424 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.409 HD23 ' NZ ' ' A' ' 73' ' ' LYS . 8.1 mp -61.51 -41.47 97.36 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.001 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 87.7 tttt -60.17 -39.27 85.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.683 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.8 tt . . . . . 0 C--N 1.329 -0.294 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.73 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -57.32 -38.3 73.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.798 0.332 . . . . 0.0 110.278 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.409 ' NZ ' HD23 ' A' ' 62' ' ' LEU . 99.3 mttt -61.35 -45.58 93.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.138 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 tp10 -60.28 -40.28 89.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.004 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.56 91.55 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -62.78 -36.58 83.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.712 ' C ' HD23 ' A' ' 77' ' ' LEU . 7.8 tt -61.78 -47.36 85.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.351 179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -44.85 96.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.269 0.557 . . . . 0.0 109.75 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.56 ' O ' HG23 ' A' ' 83' ' ' VAL . 61.7 ttp180 -57.4 -42.92 83.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.946 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.442 ' O ' HG13 ' A' ' 84' ' ' ILE . 50.4 t30 -62.56 -39.64 94.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.597 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.598 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -58.03 -49.5 76.67 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.765 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -64.0 -39.41 94.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.223 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.1 t -61.49 -45.37 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.454 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.6 mt -59.2 -50.72 78.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.246 -179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.13 -40.9 95.08 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.839 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.63 94.38 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.904 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 47.7 tttp -63.88 -47.94 78.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.629 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.2 -23.3 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.951 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 70.22 27.47 72.8 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt . . . . . 0 C--N 1.331 -0.199 0 CA-C-O 120.873 0.368 . . . . 0.0 110.458 179.779 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.463 0.218 0 CA-C-O 120.8 0.333 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.616 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 54.2 mt-10 -64.05 -33.94 76.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.978 0.418 . . . . 0.0 110.648 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.591 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 67.9 mmtt -59.79 -46.91 87.74 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.448 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.534 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 31.0 mt -69.09 -47.45 65.2 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.565 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.7 t-105 -59.71 -48.7 80.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.247 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.616 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 8.7 m-70 -69.68 -31.16 69.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.207 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.591 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.9 tptt -57.19 -51.19 70.33 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.806 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.38 -47.23 51.04 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 119.453 -0.899 . . . . 0.0 110.744 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.402 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 48.7 tttm -53.33 -51.03 63.72 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.816 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -74.54 -42.68 58.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.358 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -44.41 -27.81 0.48 Allowed 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.28 -96.46 0.11 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 119.609 -1.281 . . . . 0.0 111.506 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.705 ' O ' ' N ' ' A' ' 131' ' ' SER . 57.4 mttp -155.14 24.73 0.42 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.479 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.4 m-30 -59.48 50.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.451 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.705 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.8 m -107.52 113.26 26.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.199 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 120.98 -97.04 0.62 Allowed Glycine 0 CA--C 1.526 0.774 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.828 178.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.491 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 5.6 mp0 -74.41 -43.99 53.87 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.441 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.602 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 51.8 mp0 -63.0 -51.88 65.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.565 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -62.32 -40.26 95.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.935 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -61.66 -41.21 97.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.7 mttt -62.36 -44.05 97.39 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.05 0.452 . . . . 0.0 110.322 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mt -59.53 -43.73 93.38 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.57 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.2 OUTLIER -67.88 -33.82 75.48 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.562 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 71.7 mtp85 -53.93 -45.48 71.25 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 118.866 -1.134 . . . . 0.0 108.131 178.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.51 -37.19 71.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.604 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.57 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.6 m-85 -58.64 -58.16 9.78 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.821 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.97 -41.47 98.05 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.413 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.562 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 48.1 m170 -56.02 -42.62 76.76 Favored 'General case' 0 N--CA 1.46 0.065 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.678 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.831 ' O ' HG22 ' A' ' 149' ' ' VAL . 9.5 m-70 -65.82 -39.99 91.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.787 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -59.43 -45.29 91.97 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.257 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -71.54 -46.86 58.38 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.625 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 68.2 mttm -62.69 -46.04 89.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.751 0.31 . . . . 0.0 111.282 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.831 HG22 ' O ' ' A' ' 145' ' ' HIS . 17.7 m -65.77 -37.85 80.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.597 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.739 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -65.28 -41.58 94.03 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.74 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.82 -45.26 93.44 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.558 ' CE1' ' NZ ' ' A' ' 193' ' ' LYS . 23.1 m-85 -69.54 -47.31 64.12 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -65.62 -40.79 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.643 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 150' ' ' HIS . 56.6 t -64.05 -43.7 97.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.711 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.448 179.619 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 . . . . . 0 CA--C 1.519 -0.25 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.552 HD23 ' HE3' ' A' ' 193' ' ' LYS . 10.5 mt -60.96 -41.47 96.39 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.546 -0.462 . . . . 0.0 109.998 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.52 ' HA ' HD23 ' A' ' 194' ' ' LEU . 68.5 mttm -68.19 -35.02 77.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.16 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 86.0 tt0 -67.8 -44.93 76.18 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.153 0.501 . . . . 0.0 111.622 -178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.558 ' NZ ' ' CE1' ' A' ' 152' ' ' TYR . 0.0 OUTLIER -71.87 -38.75 69.99 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.064 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.779 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -65.15 -41.9 94.3 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.969 -0.693 . . . . 0.0 110.351 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 192' ' ' GLU . 18.8 ptp180 -65.27 -38.14 89.36 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 79.1 p -60.87 -39.03 87.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 194' ' ' LEU . 97.1 mt -63.72 -42.78 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -58.49 -41.52 85.52 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -60.37 -38.6 84.4 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . 0.416 ' O ' ' HB3' ' A' ' 203' ' ' ARG . . . -60.1 -40.3 96.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.428 ' HA ' HD23 ' A' ' 201' ' ' LEU . 19.8 mt -62.16 -40.59 96.51 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.012 -0.675 . . . . 0.0 109.742 178.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -60.31 -37.42 80.51 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 200' ' ' GLY . 5.2 tmm_? -60.84 -41.38 95.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.461 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.18 -38.17 82.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -61.08 -42.54 98.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.284 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 210' ' ' GLN . 5.7 mmp_? -64.48 -36.14 83.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.327 179.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.698 ' O ' ' N ' ' A' ' 211' ' ' GLY . 25.2 t -63.02 -44.95 99.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.194 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.59 -26.79 62.75 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.559 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . 0.426 ' ND1' ' NH1' ' A' ' 206' ' ' ARG . 45.1 t-80 -94.23 -12.93 27.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.372 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.3 tt0 -136.86 -38.33 0.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.093 0.473 . . . . 0.0 110.442 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.698 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.589 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.534 ' HG2' ' H ' ' A' ' 220' ' ' GLU . 37.8 tt0 . . . . . 0 N--CA 1.442 -0.849 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.534 ' H ' ' HG2' ' A' ' 219' ' ' GLU . 16.9 tp10 63.43 125.41 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -48.02 121.21 5.66 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 121.38 1.387 . . . . 0.0 112.811 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 178.69 -102.52 0.0 OUTLIER 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.146 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.489 HG21 HD22 ' A' ' 308' ' ' LEU . 2.6 p -60.62 -48.93 86.51 Favored 'Isoleucine or valine' 0 C--O 1.249 1.035 0 CA-C-O 121.704 0.764 . . . . 0.0 110.763 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.43 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.8 OUTLIER -63.81 -31.47 53.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.438 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 51.9 t0 -64.36 -37.99 89.46 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.4 tp -59.44 -42.84 92.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.625 ' CH2' HD23 ' A' ' 308' ' ' LEU . 45.9 m0 -60.36 -36.45 78.06 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.045 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 225' ' ' ASP . 94.0 m-20 -59.43 -40.93 88.33 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.475 ' C ' ' H ' ' A' ' 231' ' ' GLN . 8.8 mp -63.91 -40.67 97.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.321 0.582 . . . . 0.0 109.512 179.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.626 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -53.04 -8.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.846 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.853 ' O ' HD21 ' A' ' 240' ' ' LEU . 11.4 tp-100 -62.86 -43.73 98.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.795 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 54.0 p -145.0 16.48 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.576 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -59.67 -49.86 76.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.697 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . 0.515 ' ND2' ' N ' ' A' ' 234' ' ' ASN . 0.1 OUTLIER 177.54 77.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.595 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.626 HD12 ' O ' ' A' ' 230' ' ' ALA . 96.1 mt -137.19 161.89 34.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.674 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.0 p -72.95 -162.44 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.617 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -92.19 -55.58 3.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -61.93 -41.34 97.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.985 0.421 . . . . 0.0 110.335 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -63.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.853 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.2 OUTLIER -62.81 -43.02 99.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.162 -179.699 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -64.27 -49.44 71.87 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.856 0.36 . . . . 0.0 110.775 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.44 -39.77 94.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.978 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.5 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -68.01 -42.6 80.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.345 179.089 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . 0.542 ' NH2' ' OE1' ' A' ' 231' ' ' GLN . 59.2 ttm-85 -59.17 -50.17 75.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.976 -178.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.3 -40.61 86.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.791 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -62.07 -46.93 86.95 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.162 0.506 . . . . 0.0 110.415 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 251' ' ' GLU . 1.0 OUTLIER -62.02 -41.68 98.35 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.171 179.49 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.04 -42.88 81.3 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.119 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 13.6 m170 -59.42 -55.79 30.22 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.664 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -63.66 -33.85 76.54 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.694 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 29.3 tp10 -59.72 -43.33 94.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.053 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.44 86.65 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.398 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -59.9 -48.17 82.8 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.705 -179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 251' ' ' GLU . 1.3 tt -66.47 -31.76 55.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.272 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.32 -48.87 79.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.186 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.14 -42.25 99.44 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.372 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -57.64 -42.77 84.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.127 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.56 -40.43 96.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.356 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . 0.403 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 13.7 t-160 -58.38 -48.06 81.83 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.239 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -62.81 -37.08 85.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.482 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.444 ' NE2' HG21 ' A' ' 297' ' ' THR . 0.3 OUTLIER -59.17 -45.5 90.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.789 0.328 . . . . 0.0 110.435 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -61.73 -45.43 93.99 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . 0.403 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.8 mp0 -64.94 -34.92 79.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.988 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.16 -43.12 99.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.335 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -65.31 -48.22 73.84 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.992 0.425 . . . . 0.0 110.66 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 66.5 mt -63.14 -43.33 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.128 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.07 -36.94 83.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.23 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -63.03 -46.59 86.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.378 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.98 -44.55 95.74 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.453 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.41 -42.87 99.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.465 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.712 ' O ' HD23 ' A' ' 271' ' ' LEU . 2.7 tt -60.72 -43.9 97.28 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.752 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -58.66 -44.75 90.25 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.165 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 -67.75 -36.01 79.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.626 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.408 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.96 -37.11 85.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.009 -179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -58.84 -17.06 20.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.396 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 60.4 p -89.3 2.62 54.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.68 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.544 HG13 ' N ' ' A' ' 278' ' ' GLY . 14.8 p -60.18 -43.48 93.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.677 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.544 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 119.67 -67.86 0.39 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -88.61 116.91 27.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.781 0.324 . . . . 0.0 110.349 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -64.95 116.05 8.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -145.34 -44.62 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.7 0.286 . . . . 0.0 110.408 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -105.76 -6.18 19.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.457 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.55 -45.8 96.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.528 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . 0.418 ' O ' ' HG2' ' A' ' 288' ' ' GLU . 44.5 t -63.49 -51.63 64.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.513 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.82 -44.44 96.83 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.981 0.419 . . . . 0.0 110.853 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 38.6 m -60.32 -42.99 96.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.382 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -63.54 -38.33 90.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.933 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 284' ' ' SER . 76.0 mm-40 -59.89 -61.45 2.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.531 ' HD3' HD23 ' A' ' 292' ' ' LEU . 29.4 mmtt -63.4 -39.71 95.24 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.018 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -45.16 -55.41 5.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.938 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -65.43 -35.69 81.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.679 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.531 HD23 ' HD3' ' A' ' 289' ' ' LYS . 16.5 tp -60.63 -49.04 79.14 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.497 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.67 -41.52 98.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 109.973 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 295' ' ' GLY . 0.1 OUTLIER -63.92 -39.94 95.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . 0.401 ' N ' ' HG2' ' A' ' 294' ' ' GLU . . . -59.99 -50.78 63.99 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 -179.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . 0.433 ' CZ ' ' OE1' ' A' ' 299' ' ' GLU . 10.6 tpp180 -60.4 -37.79 81.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.909 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.444 HG21 ' NE2' ' A' ' 261' ' ' GLN . 9.1 m -58.91 -48.15 82.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.327 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -63.59 -41.53 98.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.729 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . 0.433 ' OE1' ' CZ ' ' A' ' 296' ' ' ARG . 96.6 mt-10 -58.77 -43.82 90.49 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.138 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.5 -43.99 97.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.393 -0.523 . . . . 0.0 109.906 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.75 -41.9 84.07 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -61.16 -45.88 92.83 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.145 0.498 . . . . 0.0 110.455 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.5 m -60.14 -43.37 95.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.313 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.36 -43.12 93.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.052 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -58.66 -46.12 87.85 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.805 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.99 -42.86 99.96 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.559 179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -65.42 -35.42 80.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.137 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.625 HD23 ' CH2' ' A' ' 227' ' ' TRP . 21.7 mt -62.29 -43.58 98.5 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.362 179.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 19.5 tm0? -65.49 -46.52 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -64.31 -49.02 73.43 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.079 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 33.1 mt -62.86 -42.78 99.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 51.0 m -60.95 -41.87 97.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.299 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.48 98.22 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.3 -47.99 79.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.773 0.32 . . . . 0.0 110.74 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . 0.481 ' O ' ' C ' ' A' ' 316' ' ' SER . 17.0 mt -77.71 -25.4 14.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 315' ' ' ILE . 42.6 t -33.1 -54.59 0.39 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.742 -179.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.2 ptt85 . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.484 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 120.698 0.285 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -81.1 -15.43 55.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.936 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.04 145.85 51.15 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 121.401 0.62 . . . . 0.0 111.166 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -64.99 -36.51 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.363 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.1 tttp -57.57 -47.93 80.76 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.276 0.56 . . . . 0.0 110.466 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.3 mt -60.8 -39.47 89.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.344 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -63.47 -39.84 95.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -57.41 -48.91 77.86 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.373 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 28' ' ' LEU . 4.2 mm? -61.38 -42.82 99.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.23 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.501 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 46.5 t-105 -61.48 -42.35 98.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.266 0.555 . . . . 0.0 110.417 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -57.72 -44.6 86.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.403 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.8 -41.57 95.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.356 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.27 93.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.428 . . . . 0.0 110.427 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.501 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.5 mt-30 -62.46 -39.42 93.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.329 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.24 -40.92 97.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.361 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.02 -39.86 95.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.429 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.64 106.94 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.896 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -129.45 155.06 80.73 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -40.47 154.33 0.06 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.65 2.233 . . . . 0.0 112.245 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.93 -36.07 32.35 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.594 2.196 . . . . 0.0 112.296 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.73 -49.77 75.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.017 0.437 . . . . 0.0 110.747 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -68.25 -39.29 82.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.464 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -63.03 -43.41 98.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.88 -43.67 87.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.634 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.57 -44.26 74.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.765 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.63 -48.4 79.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.565 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -60.88 -41.63 96.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.35 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.622 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.69 -48.79 79.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.734 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -56.37 -47.92 77.9 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.536 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.64 -39.25 83.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.075 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.98 -38.07 84.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.95 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 47' ' ' ALA . 38.6 mm -62.92 -44.38 99.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.899 179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -58.31 -43.64 88.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.332 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -60.52 -47.48 85.98 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.171 0.51 . . . . 0.0 110.322 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -62.59 -41.33 98.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.693 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -63.87 -37.33 86.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.301 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -62.63 -46.99 85.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.103 0.477 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.1 tp -61.4 -41.32 96.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.995 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.04 -41.99 99.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.532 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -58.96 -43.35 91.3 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.924 0.393 . . . . 0.0 110.275 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.78 -45.87 92.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -57.75 -42.42 83.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.997 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.4 mt -62.53 -42.34 99.46 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.016 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -56.48 -43.65 79.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.879 179.017 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.736 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -60.48 -39.18 86.71 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.345 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.518 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 3.4 mptp? -54.79 -55.87 25.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.914 0.388 . . . . 0.0 110.52 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -57.84 -39.89 78.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.021 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.53 -41.38 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.54 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.518 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 89.7 mtm180 -65.16 -39.98 93.7 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.69 -44.91 92.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.392 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.53 -45.14 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.238 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.493 ' O ' HG23 ' A' ' 83' ' ' VAL . 73.4 ttt180 -60.63 -43.24 97.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.128 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.455 ' OD1' HD11 ' A' ' 84' ' ' ILE . 26.0 t-20 -64.06 -40.13 95.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.58 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.688 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.45 -46.68 88.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.045 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -64.92 -39.87 94.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.588 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.8 t -63.75 -46.5 94.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.432 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.455 HD11 ' OD1' ' A' ' 80' ' ' ASN . 96.6 mt -60.13 -49.88 82.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.558 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' A' ' 85' ' ' LEU . 19.3 mt -65.09 -40.69 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.062 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.01 -41.1 97.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.795 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -64.77 -46.78 80.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.775 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -76.05 -19.59 58.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.394 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 65.29 26.53 71.7 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.9 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 110.669 179.971 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.954 0.407 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.538 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.3 mt-10 -60.51 -39.24 87.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.521 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.572 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.4 mttt -61.0 -44.2 97.77 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.494 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.75 -46.54 84.85 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.943 0.402 . . . . 0.0 111.71 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.587 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.7 t-105 -60.0 -47.54 85.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.369 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.538 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.9 m-70 -71.17 -32.97 69.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.429 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.572 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.8 OUTLIER -56.59 -51.02 70.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.86 -178.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.63 -46.74 58.22 Favored 'General case' 0 C--O 1.247 0.936 0 C-N-CA 120.017 -0.673 . . . . 0.0 110.596 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -52.97 -45.21 67.69 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.914 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.7 m -85.41 -40.94 15.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.691 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.557 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 13.7 m -44.54 -29.88 0.79 Allowed 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -155.36 -96.59 0.13 Allowed Glycine 0 N--CA 1.463 0.472 0 C-N-CA 119.751 -1.214 . . . . 0.0 111.31 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.731 ' O ' ' N ' ' A' ' 131' ' ' SER . 65.1 mttp -154.51 17.58 0.47 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -57.93 51.04 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.811 -179.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.731 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.5 m -109.13 123.54 49.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.139 0.495 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.61 -97.8 1.2 Allowed Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.142 178.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -74.96 -39.87 61.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.993 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.401 ' O ' HD23 ' A' ' 138' ' ' LEU . 58.5 mp0 -63.45 -52.71 60.28 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.067 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.587 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -59.8 -39.96 86.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.352 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -61.82 -38.66 88.99 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -63.1 -42.89 99.66 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.444 0.64 . . . . 0.0 109.854 178.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 138' ' ' LEU . 4.2 mm? -59.45 -42.55 92.23 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.21 -37.57 87.94 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -53.54 -41.16 66.15 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 178.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.931 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 79.9 mm-40 -69.66 -47.32 63.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -57.42 -48.75 78.29 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.2 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 143' ' ' LEU . 95.2 mt -59.76 -41.33 90.78 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.071 -0.651 . . . . 0.0 110.205 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.931 ' ND1' ' O ' ' A' ' 141' ' ' GLU . 1.8 p-80 -55.84 -43.03 76.65 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.024 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.706 ' N ' ' CD2' ' A' ' 144' ' ' HIS . 11.9 m-70 -59.8 -41.98 92.42 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.449 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -62.65 -42.44 99.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.313 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.718 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 96.5 mt-10 -67.59 -44.09 78.95 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.206 0.527 . . . . 0.0 111.297 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.47 -42.24 71.71 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.146 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.99 -50.56 76.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.828 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -72.75 -18.89 61.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.25 -179.642 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.671 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 9.7 mm-40 -70.89 -48.69 52.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.528 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 29.2 m-85 -63.77 -41.22 98.02 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.767 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.85 -38.46 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.938 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.828 HG23 ' O ' ' A' ' 150' ' ' HIS . 19.3 t -61.25 -46.28 96.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.265 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 C--N 1.324 -0.542 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.814 -179.709 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.455 ' O ' ' CD ' ' A' ' 193' ' ' LYS . 97.5 mt-10 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.833 0.349 . . . . 0.0 110.077 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.468 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 3.5 mt -61.23 -42.05 97.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.351 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.84 -29.36 67.67 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 76.3 tt0 -69.94 -50.97 36.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.978 0.418 . . . . 0.0 111.629 -179.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.528 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 1.1 ptmt -71.94 -39.41 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.783 -0.367 . . . . 0.0 111.247 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.795 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.45 -41.45 72.82 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.93 -179.493 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.518 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 50.2 ptt85 -65.87 -37.46 86.2 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 96.0 p -62.73 -41.45 99.19 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 193' ' ' LYS . 91.9 mt -65.72 -43.69 93.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.824 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -63.51 -41.27 98.51 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.685 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.855 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 47.1 mm-40 -63.5 -33.02 74.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.207 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.57 -40.6 90.73 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 201' ' ' LEU . 37.3 mt -63.74 -43.34 96.76 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.205 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.904 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 9.1 p-10 -65.82 -34.23 77.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.595 0.712 . . . . 0.0 109.213 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.904 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.1 tmt_? -63.43 -42.6 98.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.375 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 204' ' ' LEU . 49.4 mt -61.18 -39.78 91.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 33.6 mmt180 -60.19 -43.1 96.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.045 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.611 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.8 mtm-85 -64.76 -36.79 85.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.391 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.67 ' O ' ' N ' ' A' ' 211' ' ' GLY . 47.2 t -63.17 -46.46 95.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.041 0.448 . . . . 0.0 110.176 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.7 p -74.24 -26.64 60.35 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.928 0.394 . . . . 0.0 110.764 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -95.05 -14.37 24.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.292 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.611 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -138.11 -30.19 0.81 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.043 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.67 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.484 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 . . . . . 0 N--CA 1.447 -0.623 0 CA-C-O 120.856 0.36 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.86 ' O ' HG12 ' A' ' 223' ' ' VAL . 39.5 tp10 -174.01 126.77 0.44 Allowed Pre-proline 0 C--O 1.225 -0.19 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.811 176.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.631 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 72.6 Cg_exo -43.42 159.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.377 2.051 . . . . 0.0 111.755 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.631 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 65.8 ttp85 95.74 -54.44 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.619 0.575 . . . . 0.0 110.705 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 1.007 HG13 ' H ' ' A' ' 224' ' ' ILE . 4.9 p -55.91 -83.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.598 0 CA-C-O 121.351 0.596 . . . . 0.0 110.878 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 1.007 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -57.1 -24.58 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.036 -179.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -64.36 -47.55 78.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.096 0.474 . . . . 0.0 109.731 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.433 HD23 HD12 ' A' ' 229' ' ' LEU . 24.1 mt -61.35 -42.82 99.31 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.77 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.493 ' HB3' HD11 ' A' ' 247' ' ' LEU . 43.6 m0 -60.88 -36.17 78.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.983 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . 0.404 ' OD1' ' O ' ' A' ' 228' ' ' ASP . 64.8 t0 -63.74 -38.3 90.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.663 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 231' ' ' GLN . 95.0 mt -62.62 -42.18 99.43 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.1 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.403 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -38.12 -25.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.095 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 229' ' ' LEU . 7.2 tt0 -69.65 -72.47 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.805 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 79.1 p -66.18 -18.49 65.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -57.4 -53.88 53.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.876 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . 0.64 ' CG ' ' H ' ' A' ' 235' ' ' LEU . 48.5 t-20 -178.79 -143.11 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.046 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.64 ' H ' ' CG ' ' A' ' 234' ' ' ASN . 36.7 mt 80.32 144.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.661 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 24.1 p -80.57 172.47 13.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 33.0 p-10 -55.86 -44.12 77.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.638 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . 0.467 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.6 -47.99 81.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.011 0.434 . . . . 0.0 110.662 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -65.85 -36.11 82.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.68 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.755 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.46 -43.12 98.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.196 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -62.9 -48.97 76.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.477 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.17 -48.69 80.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.504 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -63.64 -39.72 95.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.323 179.283 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -57.44 -50.32 73.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.961 0.41 . . . . 0.0 110.528 -179.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.61 -36.26 83.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.563 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -60.13 -51.87 67.77 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.51 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.51 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.12 -40.38 97.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.886 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 79.3 tttt -55.65 -45.4 77.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.196 0.522 . . . . 0.0 110.337 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.86 -37.03 81.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.288 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -61.23 -49.33 77.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.065 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 11.9 pt-20 -62.83 -37.08 85.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.058 0.456 . . . . 0.0 109.851 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.83 87.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.617 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -63.53 -48.97 75.36 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.245 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.5 tt -64.2 -34.17 67.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.26 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -63.05 -48.34 79.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.053 0.454 . . . . 0.0 110.399 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.217 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -55.75 -43.2 76.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.029 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -61.83 -40.47 95.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.088 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -59.16 -47.83 83.85 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.249 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -64.24 -32.91 74.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.378 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -48.69 80.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.861 0.363 . . . . 0.0 110.186 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -61.93 -43.54 98.64 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.27 -36.85 85.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.002 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 41.6 tp -62.4 -42.47 99.45 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.137 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -62.41 -46.05 90.34 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.381 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 88.0 mt -62.51 -43.48 98.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.3 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.2 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.39 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -61.28 -46.96 88.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.211 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -61.93 -46.15 90.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.37 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -62.0 -39.2 91.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.52 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.661 ' O ' HD23 ' A' ' 271' ' ' LEU . 1.3 tt -60.11 -44.16 95.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.887 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -63.08 -40.19 96.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.271 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -67.33 -41.61 84.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.759 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.747 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.6 -41.92 99.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.82 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -56.95 -17.56 10.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.94 0.4 . . . . 0.0 110.539 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.6 t -62.6 -34.09 76.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.542 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.838 HG13 ' H ' ' A' ' 279' ' ' ASP . 8.4 p -59.16 -40.03 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.323 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 64.94 26.93 71.6 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . 0.838 ' H ' HG13 ' A' ' 277' ' ' VAL . 25.6 t0 -108.19 -8.8 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.318 . . . . 0.0 110.556 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . 0.62 ' C ' ' H ' ' A' ' 282' ' ' ARG . . . 63.99 -141.64 45.28 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 281' ' ' GLU . 78.2 tt0 58.56 -5.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . 0.62 ' H ' ' C ' ' A' ' 280' ' ' GLY . 41.9 ttm180 -140.02 -31.07 0.66 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.516 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.83 -44.07 98.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.418 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 39.6 t -60.78 -53.15 60.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.08 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 74.0 mtp85 -60.82 -46.63 89.79 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.913 0.387 . . . . 0.0 111.064 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 19.6 m -59.1 -40.24 84.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -65.78 -39.38 90.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.547 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -58.7 -59.65 5.07 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.28 0.562 . . . . 0.0 110.429 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.607 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.5 mmtm -63.23 -35.84 81.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.309 179.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -52.16 -49.04 64.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.045 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.66 -31.93 70.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.258 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.607 HD23 ' HD3' ' A' ' 289' ' ' LYS . 16.8 tp -64.25 -53.29 51.46 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.51 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.0 mp -63.6 -41.53 98.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.012 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -64.77 -39.57 93.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.169 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.15 -45.43 96.57 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . 0.653 ' C ' ' HE ' ' A' ' 296' ' ' ARG . 1.4 tmm_? -63.63 -41.88 98.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.058 0.456 . . . . 0.0 110.14 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.1 m -58.45 -49.59 76.78 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.47 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -40.13 96.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.417 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -58.48 -42.67 88.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -44.31 96.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.919 0.39 . . . . 0.0 110.462 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.28 -45.42 92.77 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -62.11 -41.76 98.55 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.098 0.475 . . . . 0.0 110.463 179.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 14.5 m -61.1 -43.97 98.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.502 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -60.03 -43.21 92.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.96 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -59.16 -48.97 79.63 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.196 0.522 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -61.74 -44.8 96.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.226 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.581 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.8 OUTLIER -63.36 -36.05 82.42 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.471 ' O ' ' OG ' ' A' ' 312' ' ' SER . 0.4 OUTLIER -58.0 -45.42 86.85 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.413 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -71.66 -57.63 4.21 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.272 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.34 -49.58 76.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.55 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 4.4 tp -61.55 -43.03 99.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.506 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 51.8 p -60.0 -40.54 89.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.15 -38.27 95.06 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.24 -45.0 95.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.78 0.324 . . . . 0.0 110.659 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . 0.638 ' O ' ' N ' ' A' ' 317' ' ' ARG . 4.1 mm -61.0 -100.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.454 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . 0.53 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.4 m 30.54 -87.11 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.309 0.576 . . . . 0.0 110.264 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.638 ' N ' ' O ' ' A' ' 315' ' ' ILE . 11.4 ptp85 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.46 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.481 0.182 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -67.25 -18.77 65.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.88 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.4 mmt -129.6 148.05 51.46 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.295 0.569 . . . . 0.0 111.116 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.669 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 49.7 mp0 -66.42 -40.94 89.86 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.698 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -56.01 -47.79 77.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.121 0.486 . . . . 0.0 110.469 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 25' ' ' LEU . 94.8 mt -61.59 -39.41 91.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.295 0.569 . . . . 0.0 109.506 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.24 -40.25 95.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.185 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.48 -42.71 96.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.209 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.88 -43.8 98.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.944 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.577 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 56.7 t-105 -61.8 -44.01 97.71 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.293 0.568 . . . . 0.0 110.369 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -56.66 -42.6 79.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.103 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.24 -42.93 99.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.205 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.73 -41.25 90.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.99 0.424 . . . . 0.0 110.274 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.577 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 73.8 mt-30 -58.79 -47.29 85.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.184 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -63.56 -34.77 78.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.19 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 35' ' ' LEU . 14.4 tp -62.43 -36.64 83.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.284 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.569 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 35.7 m170 65.89 110.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.074 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -134.74 154.19 79.3 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.74 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -40.61 153.92 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 122.562 2.174 . . . . 0.0 112.423 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.86 -50.2 5.59 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.682 2.255 . . . . 0.0 112.457 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.27 -47.82 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.575 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.4 ' NH2' ' CZ ' ' A' ' 88' ' ' TYR . 64.8 ttt-85 -63.24 -39.47 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.083 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.89 -44.42 96.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.716 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.63 94.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.401 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.58 -44.99 69.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.449 HD13 ' OH ' ' A' ' 88' ' ' TYR . 44.3 tp -63.46 -46.87 84.24 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -62.09 -42.27 99.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.37 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.29 90.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.457 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -59.71 -52.56 64.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.495 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.51 -39.73 94.45 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.2 0.524 . . . . 0.0 110.378 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.3 -45.53 87.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.016 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.61 -42.68 96.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.822 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -52.28 -42.93 64.13 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -64.86 -41.31 95.79 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -61.63 -46.71 88.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.241 0.543 . . . . 0.0 110.586 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -63.28 -35.7 81.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.485 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.41 ' OE1' ' C ' ' A' ' 56' ' ' GLU . 10.4 tm-20 -58.14 -47.66 82.65 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.985 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 57' ' ' LEU . 30.7 mt -62.31 -42.38 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.305 179.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.03 -44.36 96.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.477 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.5 t90 -59.14 -41.63 88.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -60.16 -45.89 91.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -58.39 -43.28 88.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.977 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -61.91 -39.41 91.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.851 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.35 -41.96 90.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.056 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . . . . . . 0 CA--C 1.529 0.928 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -68.15 -34.25 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.859 0.362 . . . . 0.0 110.622 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.5 mttt -59.03 -59.05 6.09 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.71 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 13.5 pt-20 -58.76 -39.23 80.39 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.043 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.403 ' N ' ' HG3' ' A' ' 74' ' ' GLU . . . -58.75 -41.43 86.48 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.406 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -64.95 -41.2 95.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.9 0.381 . . . . 0.0 110.07 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.27 -43.9 93.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.253 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 94.2 mt -64.24 -47.49 89.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.07 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.675 ' O ' HG23 ' A' ' 83' ' ' VAL . 10.3 tpp180 -60.42 -44.21 95.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.194 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.436 ' O ' HG13 ' A' ' 84' ' ' ILE . 44.9 t30 -61.91 -41.04 97.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.511 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.61 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.01 -50.13 74.48 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.129 -179.427 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -64.93 -37.17 86.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.32 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 79' ' ' ARG . 59.0 t -63.78 -45.96 95.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.442 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.01 -51.23 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.464 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.63 -40.36 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.788 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.56 79.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.966 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -61.4 -47.94 83.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.55 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.449 ' OH ' HD13 ' A' ' 45' ' ' LEU . 5.7 m-85 -61.95 -30.29 70.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.069 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.02 18.94 80.16 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 51.2 mt . . . . . 0 C--N 1.331 -0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.323 179.915 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.936 0.398 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.538 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.7 mt-10 -61.67 -38.13 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.579 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.602 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 63.7 mttp -61.22 -45.74 93.31 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.54 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.529 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 41.5 mt -64.13 -46.15 85.43 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.913 0.387 . . . . 0.0 111.888 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.648 ' CE2' HD13 ' A' ' 135' ' ' LEU . 18.0 t-105 -57.8 -49.38 76.82 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.755 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.538 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 7.7 m-70 -72.76 -31.99 65.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.46 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 1.0 OUTLIER -54.82 -51.52 65.59 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.73 -179.109 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.71 -46.59 52.9 Favored 'General case' 0 C--O 1.247 0.924 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.69 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 49.7 tttm -50.34 -41.59 51.6 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.781 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.5 m -95.08 -38.14 10.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.95 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -45.45 -27.34 0.7 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.961 0.41 . . . . 0.0 109.952 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.79 -92.26 0.09 OUTLIER Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.339 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -162.79 25.1 0.1 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.361 0.6 . . . . 0.0 109.525 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.423 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 8.7 m-85 -69.76 51.06 0.11 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.378 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 2.0 m -106.48 139.11 41.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.25 0.548 . . . . 0.0 111.747 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 89.12 -98.11 2.4 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.589 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 81.6 mm-40 -72.96 -43.83 61.83 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.96 -179.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -61.27 -49.35 77.42 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.304 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.648 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.5 mt -59.73 -40.4 87.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.306 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.56 -41.01 98.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.026 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.8 mttt -60.56 -42.75 97.24 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 121.387 0.613 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.71 -42.96 94.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.29 94.26 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.834 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -51.69 -41.64 61.6 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.65 -40.89 76.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.508 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.529 ' HZ ' HD13 ' A' ' 120' ' ' LEU . 10.7 m-85 -60.38 -52.43 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.429 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.36 -41.09 92.98 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.247 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -53.88 -46.69 71.41 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.51 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.833 ' O ' HG22 ' A' ' 149' ' ' VAL . 9.3 m-70 -61.37 -40.58 94.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -59.37 -43.67 92.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.343 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 143' ' ' LEU . 3.7 mp0 -70.7 -46.88 62.3 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.553 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.5 mttp -62.15 -47.05 86.26 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.12 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.833 HG22 ' O ' ' A' ' 145' ' ' HIS . 26.1 m -65.59 -37.13 79.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.02 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.724 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -63.81 -41.19 97.94 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.416 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -65.47 -45.65 82.87 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.332 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -62.86 -47.25 84.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 110.616 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -70.54 -46.61 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.226 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 150' ' ' HIS . 75.6 t -62.27 -46.06 97.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.702 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.4 mt . . . . . 0 C--N 1.324 -0.536 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.447 -179.443 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 . . . . . 0 CA--C 1.521 -0.151 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.592 ' HA ' ' HZ2' ' A' ' 193' ' ' LYS . 9.7 mp -63.26 -44.21 95.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 62.5 mttp -67.87 -40.0 83.64 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -68.66 -50.56 50.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.839 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.592 ' HZ2' ' HA ' ' A' ' 190' ' ' LEU . 2.6 pttm -67.09 -42.93 83.79 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.202 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.751 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.74 -37.84 76.62 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.47 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.508 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 11.6 mmm180 -63.4 -39.87 95.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 58.1 m -62.02 -42.59 99.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.77 -44.09 96.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.786 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -62.78 -40.98 99.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.522 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.58 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 95.2 mt-30 -62.03 -37.91 86.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.293 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.82 -41.48 98.82 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 201' ' ' LEU . 26.7 mt -63.82 -40.56 96.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.009 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -61.91 -38.17 87.39 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.413 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -63.45 -42.63 98.64 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.678 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.2 mt -60.56 -40.15 90.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.354 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -64.19 -43.08 96.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.062 179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.732 ' O ' ' N ' ' A' ' 210' ' ' GLN . 95.8 mtt-85 -63.14 -44.67 94.9 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.228 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.7 OUTLIER -64.39 -38.17 81.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.754 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 18.6 m -62.15 -35.7 79.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -103.89 -19.6 14.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.241 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.732 ' N ' ' O ' ' A' ' 206' ' ' ARG . 44.1 tt0 -115.84 -26.0 7.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.441 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 219' ' ' GLU . 81.1 tt0 . . . . . 0 CA--C 1.532 0.269 0 CA-C-O 120.847 0.356 . . . . 0.0 110.645 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.469 ' C ' ' O ' ' A' ' 219' ' ' GLU . 3.7 mp0 -34.86 151.04 0.07 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.663 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -76.2 47.83 2.13 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.488 2.125 . . . . 0.0 112.223 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.502 ' HA ' ' HE ' ' A' ' 222' ' ' ARG . 0.0 OUTLIER -125.86 -82.57 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.798 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.454 HG13 ' H ' ' A' ' 224' ' ' ILE . 0.3 OUTLIER -59.61 -53.37 49.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.495 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.7 OUTLIER -62.09 -34.96 66.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.356 0.598 . . . . 0.0 109.495 -179.467 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -65.91 -36.39 83.24 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.66 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.34 -43.06 92.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.61 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 43.4 m0 -62.42 -37.85 87.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.738 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -58.75 -40.61 84.37 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 231' ' ' GLN . 89.2 mt -62.96 -42.39 99.81 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.75 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.726 ' O ' HD11 ' A' ' 235' ' ' LEU . . . -38.96 -27.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 229' ' ' LEU . 17.4 tt0 -60.47 -42.44 96.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.634 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.8 m -125.64 61.66 1.23 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.655 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -127.73 -70.79 0.69 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.551 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -173.31 89.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.846 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.726 HD11 ' O ' ' A' ' 230' ' ' ALA . 0.1 OUTLIER -136.01 -156.13 0.69 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.68 -179.679 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 168.49 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.499 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -59.69 -54.55 45.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.858 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.43 -41.77 93.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.172 0.511 . . . . 0.0 110.558 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -59.43 -34.27 72.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.201 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 240' ' ' LEU . 0.1 OUTLIER -62.11 -43.25 99.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.793 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -65.85 -50.6 63.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.535 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.72 89.33 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.132 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.47 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -65.02 -42.13 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.329 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -54.69 -52.93 60.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.983 0.42 . . . . 0.0 110.434 -179.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -65.61 -38.84 90.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.92 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -57.41 -54.14 50.24 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.364 0.602 . . . . 0.0 110.616 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 247' ' ' LEU . 4.6 mm? -63.05 -37.13 85.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.534 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.558 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 43.3 tttp -55.32 -43.0 74.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 110.223 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -70.18 -39.3 75.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.334 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -60.65 -49.29 78.1 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.29 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.597 ' OE1' ' N ' ' A' ' 252' ' ' ALA . 0.1 OUTLIER -62.09 -39.4 92.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . 0.597 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.14 -37.32 85.41 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.536 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -62.74 -48.4 79.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.053 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -37.98 81.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.309 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -59.18 -47.13 86.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.511 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -63.21 -43.34 98.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.293 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . 0.404 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -58.2 -43.81 87.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.361 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . 0.421 ' OD1' ' C ' ' A' ' 258' ' ' ASN . 43.4 t-20 -61.14 -41.54 96.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.344 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -60.58 -48.56 81.24 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.1 0.476 . . . . 0.0 110.529 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -62.7 -34.56 77.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.397 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.544 HE21 ' CG2' ' A' ' 297' ' ' THR . 69.0 mm-40 -62.62 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.219 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.32 -47.72 83.0 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.087 0.47 . . . . 0.0 109.903 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.58 -37.19 86.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.936 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 61.7 tp -62.96 -42.36 99.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.198 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -61.82 -48.82 78.88 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.508 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.29 -42.77 96.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.012 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.91 83.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.153 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -62.85 -48.43 79.06 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.408 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -59.91 -46.12 90.36 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 110.473 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.36 -40.65 95.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.364 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.415 HD13 ' CB ' ' A' ' 286' ' ' SER . 33.8 tp -59.73 -43.35 94.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.086 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -59.82 -44.14 94.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.12 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -68.15 -40.7 82.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.727 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.578 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.11 -37.04 83.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.728 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . 0.666 ' OE2' HG13 ' A' ' 283' ' ' VAL . 62.1 mm-40 -55.11 -19.56 7.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.871 0.367 . . . . 0.0 110.619 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 71.1 m -76.58 -11.46 59.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.613 HG13 ' N ' ' A' ' 278' ' ' GLY . 7.9 p -63.06 -46.91 94.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.686 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.613 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 79.95 -13.3 25.86 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . 0.475 ' H ' HG13 ' A' ' 277' ' ' VAL . 81.3 m-20 -76.65 -11.6 59.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.782 0.325 . . . . 0.0 110.608 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 65.01 -140.35 41.83 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 60.72 -71.87 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.893 0.378 . . . . 0.0 110.598 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 280' ' ' GLY . 55.2 ttt85 -60.94 -33.51 73.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.416 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . 0.666 HG13 ' OE2' ' A' ' 275' ' ' GLU . 42.7 t -59.78 -45.65 94.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.548 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 45.6 t -61.16 -47.42 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.979 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.05 -47.3 80.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.922 0.391 . . . . 0.0 111.037 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . 0.415 ' CB ' HD13 ' A' ' 271' ' ' LEU . 44.4 m -59.93 -43.31 95.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.685 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -63.91 -40.63 96.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -58.79 -59.11 5.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.322 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.66 ' HD3' HD23 ' A' ' 292' ' ' LEU . 21.3 mmtm -63.96 -40.93 97.54 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.956 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -44.65 -53.96 6.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.16 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.4 -35.43 79.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.438 179.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.66 HD23 ' HD3' ' A' ' 289' ' ' LYS . 20.8 tp -60.39 -50.22 74.47 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.322 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.36 -42.08 98.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.303 0.573 . . . . 0.0 109.936 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.501 ' O ' ' OG1' ' A' ' 297' ' ' THR . 16.2 tm-20 -62.0 -39.71 93.16 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.955 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.91 -40.91 99.86 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 7.9 tpp180 -61.73 -43.73 98.28 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.323 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.544 ' CG2' HE21 ' A' ' 261' ' ' GLN . 44.0 p -60.42 -43.85 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.263 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -62.78 -43.92 97.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.461 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -61.5 -42.02 98.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.283 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -44.59 96.46 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.412 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.26 -44.89 93.21 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -62.15 -41.98 98.81 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.115 0.483 . . . . 0.0 110.462 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . 0.423 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 19.3 m -60.52 -44.5 95.97 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.424 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -61.26 -42.35 93.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.896 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -56.98 -48.33 78.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.075 0.465 . . . . 0.0 110.313 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.34 -41.55 98.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.694 179.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.423 ' ND1' ' O ' ' A' ' 303' ' ' THR . 37.4 m80 -65.01 -36.47 84.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.239 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.61 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 6.0 mt -62.38 -44.84 95.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.835 0.35 . . . . 0.0 110.34 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -69.86 -42.87 72.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.472 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -64.19 -45.23 89.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.791 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 23.1 mt -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.741 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 95.4 p -61.94 -38.49 88.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.357 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.57 -42.9 95.36 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -66.1 -67.32 0.45 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.761 0.315 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . 0.585 ' O ' ' N ' ' A' ' 317' ' ' ARG . 4.8 mt -53.02 -94.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . 0.549 ' C ' ' O ' ' A' ' 315' ' ' ILE . 6.6 t 25.08 -88.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.914 0.388 . . . . 0.0 110.575 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 315' ' ' ILE . 55.4 ttp180 . . . . . 0 C--N 1.33 -0.256 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.864 0.364 . . . . 0.0 110.726 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.488 HH12 HD22 ' A' ' 57' ' ' LEU . 90.0 mtm180 -93.75 6.01 49.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.364 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.519 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 10.0 tpt -144.88 130.07 18.58 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -60.95 -38.29 85.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.357 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.8 -47.97 81.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.569 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 25' ' ' LEU . 95.6 mt -61.5 -38.63 88.05 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.727 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.519 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.4 m-80 -64.18 -40.13 95.46 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.488 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -60.77 -49.58 76.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.74 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.469 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 3.6 mm? -61.92 -40.88 97.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.215 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 47.7 t-105 -61.84 -46.26 90.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.134 0.492 . . . . 0.0 110.423 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.471 ' HA ' HE21 ' A' ' 33' ' ' GLN . 95.4 mt-10 -57.59 -42.85 83.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.462 179.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -61.6 -42.78 99.36 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.99 -44.69 87.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.162 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.471 HE21 ' HA ' ' A' ' 30' ' ' GLU . 33.8 mt-30 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.172 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -60.2 -43.48 95.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.142 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.9 mt -65.01 -36.87 85.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.261 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.85 110.37 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.741 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.8 mt -127.33 155.81 75.87 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.806 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -40.94 154.42 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.535 2.157 . . . . 0.0 112.189 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.71 -47.14 26.88 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.548 2.165 . . . . 0.0 112.556 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.25 -45.08 97.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.412 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.539 ' O ' HD13 ' A' ' 45' ' ' LEU . 22.2 mmt85 -63.86 -40.59 96.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.53 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 tp -62.54 -43.71 98.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.529 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.98 89.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.412 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -67.9 -48.56 65.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 41' ' ' ARG . 8.1 mp -62.98 -45.46 92.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.646 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -63.8 -44.11 94.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.851 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.631 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.18 -48.73 80.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.071 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -57.43 -46.89 83.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.926 0.393 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.13 -40.84 86.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.917 0.389 . . . . 0.0 110.046 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.22 -39.91 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.088 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.631 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.9 mm -62.3 -43.78 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.054 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -58.62 -45.32 89.45 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.542 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.34 -47.01 87.03 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.128 0.489 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -64.16 -39.56 94.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.684 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.426 ' C ' ' OD1' ' A' ' 55' ' ' ASP . 60.4 t0 -60.56 -43.46 97.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.597 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -61.72 -43.88 97.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.033 0.444 . . . . 0.0 110.135 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.488 HD22 HH12 ' A' ' 21' ' ' ARG . 52.1 tp -60.5 -41.74 94.91 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.199 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.3 99.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.605 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.8 -42.41 93.36 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.342 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -61.08 -45.45 94.67 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -57.84 -44.02 86.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.179 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.9 mt -61.92 -42.11 98.72 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.139 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -56.26 -47.05 79.3 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.27 -0.572 . . . . 0.0 109.639 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.946 178.991 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.79 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -64.31 -35.13 79.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.701 0.286 . . . . 0.0 110.275 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.409 ' O ' HD13 ' A' ' 77' ' ' LEU . 65.7 mttm -58.04 -59.8 4.72 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.129 0.49 . . . . 0.0 110.162 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -55.57 -41.48 73.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.283 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.685 ' HB1' ' NH1' ' A' ' 79' ' ' ARG . . . -61.2 -38.67 87.37 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.352 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -62.49 -42.94 99.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 73' ' ' LYS . 10.2 mp -62.47 -43.08 99.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.49 -47.52 91.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.215 0.531 . . . . 0.0 110.134 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.685 ' NH1' ' HB1' ' A' ' 75' ' ' ALA . 77.3 mtt85 -61.21 -41.22 96.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.218 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.436 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.58 -49.26 78.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.082 0.468 . . . . 0.0 110.346 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.07 -38.54 88.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 79' ' ' ARG . 48.1 t -62.14 -47.05 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.636 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.8 -49.35 84.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.436 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 85' ' ' LEU . 13.7 tp -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.035 0.445 . . . . 0.0 110.724 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.84 93.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.849 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -61.63 -48.38 81.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.435 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -76.25 -16.31 59.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.12 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 58.51 38.42 91.03 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 90' ' ' LEU . 39.5 mt . . . . . 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 110.547 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.0 mt . . . . . 0 N--CA 1.462 0.136 0 CA-C-O 120.863 0.363 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.627 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 39.6 mt-10 -58.44 -42.2 86.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.8 mttt -60.16 -42.55 95.16 Favored 'General case' 0 C--N 1.318 -0.761 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.435 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.4 mt -64.4 -47.44 79.18 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.068 0.461 . . . . 0.0 111.773 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.635 ' CZ2' HD13 ' A' ' 135' ' ' LEU . 10.2 t-105 -64.24 -44.78 90.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.592 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.627 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -69.24 -34.98 75.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.745 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.554 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.4 mptt -60.25 -51.2 70.58 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.232 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -74.57 -46.31 39.63 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.722 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.45 ' HB2' HD11 ' A' ' 135' ' ' LEU . 62.9 tttp -53.21 -44.26 67.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.311 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -102.68 -60.08 1.6 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.935 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -61.65 -6.21 2.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.787 -178.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -135.65 4.41 4.0 Favored Glycine 0 C--N 1.329 0.174 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.486 ' CG ' ' O ' ' A' ' 128' ' ' GLY . 19.0 ptpt 43.44 21.09 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.17 0.509 . . . . 0.0 109.84 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.495 ' N ' ' O ' ' A' ' 128' ' ' GLY . 32.8 m-85 -78.78 50.75 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.586 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.7 p -94.5 130.11 41.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 112.105 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.13 -98.72 1.33 Allowed Glycine 0 CA--C 1.534 1.267 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.869 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.446 ' HG2' ' H ' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -80.3 -43.64 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.049 -179.226 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 133' ' ' GLU . 67.8 mm-40 -64.96 -42.96 94.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.635 HD13 ' CZ2' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.79 -43.51 98.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.942 179.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -62.3 -39.29 92.51 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.952 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -60.41 -43.29 96.87 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.37 0.605 . . . . 0.0 109.852 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 134' ' ' GLU . 2.8 mm? -59.68 -43.84 93.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -36.92 85.65 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.55 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 88.7 mtt-85 -53.49 -41.51 66.33 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.542 ' N ' ' OE1' ' A' ' 141' ' ' GLU . 0.4 OUTLIER -71.26 -43.36 67.36 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.853 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -58.47 -54.86 42.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.407 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.49 -38.91 89.04 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.309 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 34.9 m170 -54.75 -42.79 72.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.613 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -66.31 -39.8 89.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.637 178.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -61.27 -47.25 86.87 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.379 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.8 pt-20 -71.49 -43.01 67.33 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.541 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.417 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 96.9 mttt -62.67 -44.13 97.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.797 0.332 . . . . 0.0 110.456 -179.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.9 t -64.4 -44.43 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.603 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.776 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -60.63 -39.58 88.75 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.43 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.81 -43.18 99.48 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.678 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.584 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 24.5 m-85 -65.45 -49.63 68.43 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.842 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -68.62 -42.26 78.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.023 0.44 . . . . 0.0 110.997 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 150' ' ' HIS . 73.2 t -63.03 -45.16 99.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.947 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.5 mt . . . . . 0 C--N 1.329 -0.316 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.761 179.904 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 . . . . . 0 C--O 1.231 0.103 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.517 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 8.5 mp -63.18 -41.06 99.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.459 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.546 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 67.5 mttm -67.35 -34.06 76.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.59 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 97.2 mt-10 -67.6 -50.28 58.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.584 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 10.6 ptmt -72.28 -44.7 62.39 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.358 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.769 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.95 -41.51 86.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.102 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.546 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -65.92 -36.88 84.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 55.6 m -61.56 -43.38 98.97 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.42 -44.12 97.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.849 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.439 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.3 m-20 -62.0 -42.05 98.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.582 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.477 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 14.9 mm100 -62.24 -38.59 89.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.381 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.4 -42.3 99.74 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 201' ' ' LEU . 18.3 mt -63.25 -41.97 99.12 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.235 179.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.498 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.1 OUTLIER -62.8 -36.64 83.8 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -63.92 -42.27 97.43 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.616 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.48 -39.43 90.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.409 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -62.04 -45.12 94.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.222 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.554 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.7 mtt180 -65.3 -36.58 84.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.16 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.51 -45.88 96.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.252 0.548 . . . . 0.0 110.279 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 80.6 p -72.37 -26.67 61.98 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.535 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -95.34 -14.58 23.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.513 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -146.11 -25.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.718 0.294 . . . . 0.0 111.109 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.518 0.271 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 220' ' ' GLU . 2.2 tm-20 . . . . . 0 N--CA 1.445 -0.695 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 59.3 mt-10 -87.26 148.97 46.05 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.163 176.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.75 81.93 1.27 Allowed 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.564 2.176 . . . . 0.0 112.146 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 175.98 -36.6 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.752 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.916 HG13 ' H ' ' A' ' 224' ' ' ILE . 1.5 p -68.92 -76.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.168 0.508 . . . . 0.0 110.698 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.916 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.2 mp -50.61 -26.65 4.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.132 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -67.01 -50.03 63.43 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.371 0.605 . . . . 0.0 109.943 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 12.3 tp -56.79 -37.41 71.1 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 44.8 m0 -63.96 -42.56 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.193 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . 0.507 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 97.1 m-20 -66.76 -18.44 65.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 1.7 mt -77.81 -44.61 26.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.061 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 232' ' ' SER . . . -36.68 -62.16 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.198 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.507 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 7.4 pt20 -38.39 -31.94 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.673 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.413 ' N ' ' O ' ' A' ' 230' ' ' ALA . 66.5 m -118.4 52.62 1.01 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.374 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -141.41 46.26 1.71 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . 0.542 ' ND2' ' N ' ' A' ' 234' ' ' ASN . 0.8 OUTLIER 61.95 72.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.379 179.574 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 235' ' ' LEU . 20.0 mt -125.08 148.04 48.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.696 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 66.6 p -66.36 -165.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.463 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . 0.548 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 31.3 p-10 -95.84 -48.18 5.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . 0.548 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 97.9 mttt -62.58 -43.35 99.03 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.03 0.443 . . . . 0.0 110.675 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -64.68 -33.63 76.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.013 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.67 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.2 OUTLIER -62.56 -43.49 98.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.306 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -65.12 -49.66 69.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.405 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.14 -39.91 91.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.089 0.471 . . . . 0.0 110.002 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.486 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.14 -44.11 93.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.103 179.033 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 244' ' ' ARG . 0.0 OUTLIER -60.03 -47.55 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.036 0.445 . . . . 0.0 110.193 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -65.62 -47.43 75.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.751 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -56.28 -50.94 69.93 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.495 0.664 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.6 mm? -63.43 -37.82 88.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.776 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.452 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 89.0 tttt -53.76 -45.38 70.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.391 0.615 . . . . 0.0 109.995 -179.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -67.48 -40.63 85.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.697 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -61.01 -48.98 79.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.638 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.452 ' CG ' ' O ' ' A' ' 248' ' ' LYS . 13.5 pt-20 -59.31 -38.16 79.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . 0.422 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -65.48 -38.17 88.98 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.521 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -62.9 -49.57 74.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.554 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 9.7 tt -64.97 -31.84 55.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.17 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -62.22 -46.36 89.22 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.214 0.53 . . . . 0.0 110.054 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.22 -42.48 99.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.973 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -56.42 -43.83 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.339 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -61.93 -40.79 96.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.118 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -57.03 -46.33 82.45 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.274 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -63.7 -37.4 87.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.513 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 30.8 mm-40 -57.72 -48.72 78.79 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.35 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -62.28 -43.1 99.61 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.189 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -65.49 -35.42 80.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.973 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 39.4 tp -63.7 -43.85 95.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.42 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -64.21 -44.72 91.06 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.542 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.44 -42.93 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.089 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.61 87.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.361 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -62.02 -48.52 79.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -61.61 -46.69 88.78 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 110.66 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.78 -37.66 85.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.349 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 49.3 tp -61.82 -43.99 97.74 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -61.59 -43.0 99.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.41 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -72.13 -37.69 69.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.61 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -63.1 -37.12 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.862 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.7 -30.77 71.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.715 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 90.7 p -86.71 2.43 48.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.712 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 274' ' ' ALA . 9.5 p -60.74 -41.97 90.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.455 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.514 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 123.73 -57.45 0.65 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -96.74 111.35 23.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.803 0.335 . . . . 0.0 110.584 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -74.08 106.93 2.13 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -136.6 -21.08 1.32 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.311 . . . . 0.0 110.651 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -124.81 -4.22 7.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.705 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . 0.57 HG13 ' N ' ' A' ' 284' ' ' SER . 11.3 p -63.24 -46.04 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . 0.57 ' N ' HG13 ' A' ' 283' ' ' VAL . 10.6 t -63.78 -49.34 73.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.075 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.53 -43.03 98.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.86 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 48.5 t -60.27 -44.56 95.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.52 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 290' ' ' HIS . 60.0 ttt85 -63.24 -41.05 99.04 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.228 0.537 . . . . 0.0 110.632 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -56.81 -57.51 12.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.252 0.548 . . . . 0.0 109.959 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.564 ' HD3' HD23 ' A' ' 292' ' ' LEU . 46.8 mmtt -64.54 -31.34 72.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.153 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 287' ' ' ARG . 52.0 t-80 -53.13 -49.93 65.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.29 -37.62 71.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.618 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.564 HD23 ' HD3' ' A' ' 289' ' ' LYS . 26.3 tp -61.46 -50.76 71.46 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.594 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.3 mp -63.82 -41.65 97.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.135 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.16 -40.46 97.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.323 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.69 -47.21 91.8 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -63.66 -37.45 87.39 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.51 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.513 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 8.3 m -60.23 -50.27 74.31 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.488 -179.202 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.41 -40.07 96.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.412 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -58.93 -45.47 90.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.358 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.46 -44.51 96.98 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.297 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.36 -43.56 84.74 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . 0.475 ' CE1' ' NZ ' ' A' ' 306' ' ' LYS . 49.3 t80 -62.25 -42.43 99.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.162 0.506 . . . . 0.0 110.489 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . 0.454 HG22 ' ND1' ' A' ' 307' ' ' HIS . 17.2 m -60.48 -44.29 96.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.643 -179.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.31 -43.25 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.046 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.79 -49.44 76.61 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.045 0.45 . . . . 0.0 110.937 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . 0.475 ' NZ ' ' CE1' ' A' ' 302' ' ' TYR . 34.7 mmtm -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.805 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.454 ' ND1' HG22 ' A' ' 303' ' ' THR . 20.6 m80 -66.31 -31.25 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.921 179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.65 HD21 ' CG2' ' A' ' 223' ' ' VAL . 0.5 OUTLIER -61.12 -49.92 75.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.238 -179.706 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -69.71 -40.1 76.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.634 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -60.05 -51.17 70.76 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.885 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 311' ' ' LEU . 30.2 mt -63.25 -39.82 95.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.442 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.7 t -58.89 -43.41 90.94 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.685 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.9 -49.89 56.1 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . 0.741 ' N ' ' HE ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.93 -43.6 95.4 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.7 mm -64.34 -43.14 97.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.809 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 99.5 p -56.07 -34.55 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.864 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 14.3 tpp180 . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.493 -179.352 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 . . . . . 0 N--CA 1.462 0.171 0 CA-C-O 121.022 0.439 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp85 -77.4 -11.48 59.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.69 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -134.83 145.7 48.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 110.988 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.35 -33.65 76.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.722 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.4 ' O ' HD23 ' A' ' 28' ' ' LEU . 58.1 mttm -59.02 -47.23 85.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 109.887 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.467 ' N ' HD12 ' A' ' 25' ' ' LEU . 9.4 mp -64.13 -37.94 89.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.292 178.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -63.79 -41.24 97.96 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.602 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -65.15 -45.12 86.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.107 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.409 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 1.6 mm? -63.36 -41.78 98.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.479 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -63.29 -47.81 80.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.09 0.472 . . . . 0.0 110.358 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.5 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 80.8 tt0 -60.83 -39.19 88.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.199 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -45.0 96.38 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.06 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -41.36 96.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -59.45 -40.05 85.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.027 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.5 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -64.57 -39.01 92.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.339 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.4 mt -63.54 -36.73 84.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.383 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 65.95 106.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.604 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -129.4 154.47 80.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.63 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 74.3 Cg_exo -43.95 153.77 0.28 Allowed 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.369 2.046 . . . . 0.0 112.528 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.4 Cg_exo -58.73 -41.05 67.31 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.681 2.254 . . . . 0.0 112.364 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.01 -49.12 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.852 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.74 -41.57 92.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.622 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -65.25 -42.36 93.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -51.71 64.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.176 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.01 -38.48 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.504 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.9 tp -62.16 -50.77 70.51 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.043 0.449 . . . . 0.0 110.621 -179.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -61.1 -40.82 95.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.21 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.615 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.29 -49.77 75.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.073 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -58.82 -46.03 88.58 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.996 0.427 . . . . 0.0 110.584 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.0 mt -59.93 -41.07 90.95 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -58.99 -38.79 80.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.145 178.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 47' ' ' ALA . 45.5 mm -62.16 -44.42 99.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -58.81 -43.96 90.69 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.606 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.97 -48.37 81.79 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.971 0.415 . . . . 0.0 110.453 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -60.25 -44.54 95.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.752 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.94 -40.66 94.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.505 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.07 -45.74 91.9 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 110.103 179.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.31 -42.97 99.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.966 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.83 96.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.557 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.2 t90 -58.52 -44.08 89.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.095 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.77 -46.5 90.21 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 120.624 -0.43 . . . . 0.0 109.914 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.11 -41.05 97.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.085 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.449 HD13 ' HZ2' ' A' ' 73' ' ' LYS . 79.7 mt -61.62 -41.2 97.14 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.45 -38.74 88.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.667 ' O ' HD23 ' A' ' 64' ' ' LEU . 3.1 tt . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.57 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.02 -40.69 91.29 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.573 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.449 ' HZ2' HD13 ' A' ' 62' ' ' LEU . 39.7 mtpt -62.49 -47.81 82.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.021 0.439 . . . . 0.0 110.362 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.99 -42.55 94.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.467 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.84 -40.28 94.77 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -62.25 -41.97 98.92 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.608 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.52 -43.8 96.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.444 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.77 -45.66 94.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.302 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.776 ' O ' HG23 ' A' ' 83' ' ' VAL . 92.1 mtt-85 -63.09 -41.29 99.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.992 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.405 ' HA ' HD22 ' A' ' 80' ' ' ASN . 10.4 m120 -64.03 -39.59 94.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.337 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.587 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -60.16 -51.39 69.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.901 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.436 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 60.7 t-20 -66.23 -38.91 89.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.705 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 79' ' ' ARG . 60.8 t -62.29 -47.46 92.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.691 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.9 -47.11 94.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.63 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 85' ' ' LEU . 11.6 tp -66.23 -41.11 90.51 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.638 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.59 -47.62 84.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.989 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -62.64 -44.8 95.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 110.404 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -63.65 -32.74 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.065 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 79.46 22.61 64.43 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.8 mt . . . . . 0 C--N 1.332 -0.157 0 CA-C-O 120.886 0.374 . . . . 0.0 110.338 -179.88 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.863 0.364 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 93.5 mt-10 -59.5 -44.02 93.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 20.3 pttp -60.6 -41.5 94.89 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.257 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.429 ' N ' ' CG ' ' A' ' 119' ' ' LYS . 11.8 mt -62.12 -44.92 95.59 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.638 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.578 ' CZ3' HD22 ' A' ' 135' ' ' LEU . 15.6 t-105 -61.76 -47.16 86.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.318 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.508 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.9 m-70 -67.68 -38.9 84.34 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.125 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.545 ' O ' ' CB ' ' A' ' 127' ' ' SER . 12.9 tptt -58.58 -51.45 69.83 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.911 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.04 -45.75 63.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.649 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.407 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 65.0 tttm -48.33 -44.45 34.19 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 128' ' ' GLY . 23.3 m -107.08 -60.54 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.818 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.71 -8.87 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.898 -178.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.556 ' C ' ' H ' ' A' ' 130' ' ' PHE . . . -137.58 4.38 3.34 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 48.92 11.03 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.135 0.493 . . . . 0.0 109.786 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.556 ' H ' ' C ' ' A' ' 128' ' ' GLY . 24.3 m-85 -71.58 50.45 0.18 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.421 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.47 ' HA ' HD12 ' A' ' 135' ' ' LEU . 4.7 p -97.94 112.9 24.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 112.145 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.44 -98.37 0.62 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.711 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.465 ' CG ' ' N ' ' A' ' 134' ' ' GLU . 10.0 pt-20 -77.18 -44.0 31.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.839 0.352 . . . . 0.0 111.31 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.465 ' N ' ' CG ' ' A' ' 133' ' ' GLU . 79.5 mm-40 -66.08 -41.92 90.05 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.578 HD22 ' CZ3' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.07 -43.18 99.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.862 179.373 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.513 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.3 OUTLIER -62.31 -37.99 87.68 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.936 179.769 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.434 ' N ' ' OD1' ' A' ' 136' ' ' ASP . 36.2 mmtm -60.15 -44.15 95.2 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.981 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.6 mm? -60.64 -43.03 98.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.34 -34.84 79.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 177.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -58.5 -39.09 79.09 Favored 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.988 178.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.489 ' OE1' HD21 ' A' ' 204' ' ' LEU . 97.4 mt-10 -70.62 -44.29 67.51 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.995 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -58.91 -56.29 24.18 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.74 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.785 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 97.4 mt -60.82 -39.84 90.53 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.579 -0.448 . . . . 0.0 109.815 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -55.19 -41.28 71.75 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.479 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -63.87 -45.88 87.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.384 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.785 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 46.7 pttt -57.55 -45.75 84.74 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.549 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.533 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 77.8 mm-40 -68.91 -50.18 51.7 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -63.09 -44.32 96.04 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.975 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 1.2 p -64.88 -38.09 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.716 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.3 m170 -65.92 -41.26 91.63 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.228 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.38 -43.16 95.37 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.939 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.52 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 3.8 m-85 -61.88 -50.84 70.62 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.853 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -69.77 -44.05 70.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.307 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 150' ' ' HIS . 74.2 t -63.4 -46.9 94.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.922 -179.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 74.0 mt . . . . . 0 C--O 1.239 0.509 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.401 -179.807 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 . . . . . 0 CA--C 1.52 -0.178 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.721 HD23 ' HZ1' ' A' ' 193' ' ' LYS . 14.2 mt -61.73 -45.55 93.43 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.083 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 55.9 pttt -80.45 -34.28 36.12 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.582 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 42.7 tt0 -69.24 -42.89 75.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.026 -179.33 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.721 ' HZ1' HD23 ' A' ' 190' ' ' LEU . 10.1 pttm -74.34 -43.2 57.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -68.6 -40.01 80.65 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.873 -179.726 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.491 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.2 ptm180 -67.6 -39.62 84.78 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 75.5 p -60.49 -40.79 92.58 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -64.93 -43.42 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.894 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -62.58 -42.46 99.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.776 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -65.75 -32.29 73.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.081 178.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.02 -46.18 94.03 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 201' ' ' LEU . 28.9 mt -63.42 -42.02 98.72 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.028 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.59 -36.58 84.27 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -42.02 98.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.379 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.489 HD21 ' OE1' ' A' ' 141' ' ' GLU . 78.7 mt -61.62 -41.55 97.63 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -64.25 -42.48 96.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.024 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.696 ' O ' ' N ' ' A' ' 210' ' ' GLN . 15.4 mmm180 -65.32 -40.9 94.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.981 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.66 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.2 t -63.77 -45.38 97.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.043 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.9 p -67.85 -28.19 67.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.762 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -101.66 -14.67 17.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.61 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.696 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.6 tt0 -131.59 -28.2 1.86 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.86 0.362 . . . . 0.0 111.107 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.66 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.52 0.382 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.401 ' O ' ' CD ' ' A' ' 219' ' ' GLU . 8.4 tm-20 . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -60.74 155.59 50.65 Favored Pre-proline 0 N--CA 1.464 0.235 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.203 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 31.7 Cg_exo -57.12 119.32 6.51 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 C-N-CA 122.149 1.9 . . . . 0.0 112.051 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 63.2 ttm-85 178.63 -93.58 0.0 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.757 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.559 HG11 HD22 ' A' ' 308' ' ' LEU . 0.2 OUTLIER -60.55 -47.16 93.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.733 -179.388 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.429 HD11 ' HE1' ' A' ' 250' ' ' PHE . 1.1 mp -65.41 -26.71 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.836 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -67.45 -46.54 72.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 109.767 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.566 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 5.0 tp -61.14 -41.27 96.43 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.354 179.302 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.469 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 44.2 m0 -60.06 -42.01 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.066 -0.653 . . . . 0.0 109.677 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -65.06 -29.84 70.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 4.0 mt -62.2 -43.26 99.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.872 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.932 ' O ' HD21 ' A' ' 235' ' ' LEU . . . -36.07 -42.91 0.31 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.919 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -39.53 -34.24 0.21 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.855 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 39.3 m -130.87 66.14 1.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.532 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . 0.936 ' H ' HD11 ' A' ' 235' ' ' LEU . . . -144.2 46.7 1.42 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 58.9 t30 63.17 73.56 0.45 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.494 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.936 HD11 ' H ' ' A' ' 233' ' ' ALA . 0.3 OUTLIER -108.85 -160.32 0.72 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.095 0.474 . . . . 0.0 110.843 179.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.4 ' OG1' ' CD ' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -131.74 -146.97 0.3 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.746 -179.157 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -101.59 -66.17 0.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.814 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.35 -40.9 97.92 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.446 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . 0.409 ' HG3' ' H ' ' A' ' 239' ' ' GLU . 34.0 mt-10 -61.93 -35.38 78.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.884 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.15 -46.04 89.05 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.79 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -65.34 -44.81 86.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.473 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.27 -41.45 93.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.49 -44.67 93.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.724 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -58.76 -52.98 63.39 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 -178.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -64.96 -36.91 85.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.697 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -61.79 -45.0 95.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.359 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.488 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 1.9 mm? -63.34 -41.23 98.86 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.768 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.74 -39.81 90.08 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.888 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -63.96 -63.04 1.26 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . 0.436 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 29.4 t80 -59.78 -45.23 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 0.0 110.924 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.488 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 53.1 tp10 -55.03 -41.58 71.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.15 80.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -59.92 -45.83 91.34 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.838 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . 0.468 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.4 tp -66.84 -42.42 89.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.919 179.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.34 -45.59 92.91 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.713 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.73 -41.58 99.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.29 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -43.45 81.04 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -61.58 -40.79 96.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.212 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . 0.513 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 79.7 t60 -58.96 -47.95 83.29 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.212 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -62.29 -37.04 83.97 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.344 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -43.79 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -61.82 -46.92 87.38 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.805 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . 0.513 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.0 mp0 -63.39 -36.77 84.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.864 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 50.3 tp -61.66 -42.46 98.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.348 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -63.05 -46.8 85.8 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.74 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.6 mt -63.02 -42.98 98.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.965 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.81 83.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.084 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -62.18 -44.88 95.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.35 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -59.24 -46.84 87.42 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.048 0.451 . . . . 0.0 110.344 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -60.48 -40.38 91.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.345 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.4 ' CD2' ' OE2' ' A' ' 275' ' ' GLU . 5.4 tt -59.52 -44.11 93.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -59.37 -44.48 92.73 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.995 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -67.63 -42.62 82.04 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.668 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . 0.637 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -60.7 -35.35 76.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.926 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . 0.4 ' OE2' ' CD2' ' A' ' 271' ' ' LEU . 90.7 mt-10 -61.31 -28.83 69.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.843 0.354 . . . . 0.0 110.447 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 97.1 p -89.1 5.91 42.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 274' ' ' ALA . 11.8 p -60.88 -44.2 97.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.702 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . 0.56 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 134.76 -86.67 0.25 Allowed Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -62.93 -39.96 96.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.721 0.296 . . . . 0.0 110.603 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . 0.578 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 87.91 -106.52 3.22 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 63.16 -53.8 0.19 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.851 0.358 . . . . 0.0 110.568 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . 0.578 ' N ' ' O ' ' A' ' 280' ' ' GLY . 16.4 ptm180 -72.26 -15.42 61.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.509 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.8 t -60.61 -44.95 97.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.43 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.1 t -59.97 -44.9 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.006 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -61.59 -43.21 99.29 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.025 0.44 . . . . 0.0 110.532 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 5.6 t -60.94 -42.35 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.093 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -61.67 -41.72 97.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.279 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -57.62 -53.74 54.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.262 -0.427 . . . . 0.0 109.895 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.445 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.1 mmtm -64.62 -34.36 78.09 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.211 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -58.21 -46.41 85.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.058 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.78 -40.36 79.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.913 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.699 ' O ' HD12 ' A' ' 292' ' ' LEU . 1.3 tp -62.92 -52.86 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.87 -43.28 99.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.149 0.5 . . . . 0.0 110.232 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.01 -36.54 84.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.88 -50.44 65.76 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 110.539 -1.025 . . . . 0.0 110.539 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -59.69 -41.28 90.36 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 5.9 m -59.45 -49.15 78.92 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 120.962 0.41 . . . . 0.0 110.04 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -63.72 -44.29 94.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -57.74 -40.22 79.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.03 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.24 -43.14 99.49 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.855 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.95 -43.4 94.93 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -61.88 -44.45 96.79 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.095 0.474 . . . . 0.0 110.778 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.5 m -60.07 -43.7 95.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.206 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.4 -44.24 92.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.924 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.78 -54.66 43.81 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.076 -179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -62.98 -41.69 99.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.46 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.696 ' NE2' HD13 ' A' ' 311' ' ' LEU . 5.3 t-160 -61.68 -39.15 90.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.047 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.559 HD22 HG11 ' A' ' 223' ' ' VAL . 26.0 mt -60.66 -44.55 96.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.439 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . 0.598 ' OE1' ' N ' ' A' ' 309' ' ' GLN . 0.0 OUTLIER -63.12 -49.31 74.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.592 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -63.03 -68.88 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.158 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.696 HD13 ' NE2' ' A' ' 307' ' ' HIS . 1.8 tp -41.68 -46.4 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.704 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 56.6 m -60.02 -41.8 92.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.514 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.59 -35.96 92.57 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . 0.551 ' O ' ' O ' ' A' ' 315' ' ' ILE . 18.1 mmm180 -73.54 -64.69 0.94 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.829 0.314 . . . . 0.0 110.977 -179.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . 0.721 HG22 ' N ' ' A' ' 316' ' ' SER . 0.8 OUTLIER -40.59 -104.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.228 -179.071 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . 0.721 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.0 OUTLIER 62.37 -5.27 0.18 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.583 ' H ' ' C ' ' A' ' 315' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.372 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 . . . . . 0 C--O 1.234 0.267 0 CA-C-O 120.658 0.266 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -64.48 -36.8 85.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.82 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.6 mmm -118.56 148.75 42.33 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.21 0.529 . . . . 0.0 110.788 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.67 -38.12 88.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.694 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.29 -47.59 83.16 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.185 0.517 . . . . 0.0 110.321 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.9 tp -63.14 -38.59 91.78 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.501 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -64.24 -40.02 95.15 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.379 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.7 tp60 -62.81 -42.21 99.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.163 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -62.08 -44.4 96.74 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.016 0.436 . . . . 0.0 109.95 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -60.51 -49.57 77.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.362 0.601 . . . . 0.0 110.385 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -58.22 -38.54 77.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.279 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 tppt? -60.61 -46.06 91.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.179 0.514 . . . . 0.0 110.235 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.46 91.91 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.006 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.586 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 89.2 mt-30 -58.58 -38.64 78.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.194 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.589 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 62.8 ttm-85 -62.47 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.45 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.512 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.589 ' CE1' ' O ' ' A' ' 34' ' ' ARG . 25.9 m80 66.0 113.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.7 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 mt -137.45 154.99 75.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.858 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -43.31 155.1 0.16 Allowed 'Trans proline' 0 C--N 1.311 -1.434 0 C-N-CA 122.657 2.238 . . . . 0.0 112.12 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -65.43 -34.78 42.21 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.648 2.232 . . . . 0.0 112.094 -179.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.41 HG22 ' H ' ' A' ' 40' ' ' VAL . 3.0 m -68.02 -47.94 76.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.673 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.408 ' H ' HG23 ' A' ' 40' ' ' VAL . 96.9 mtt180 -66.87 -40.06 87.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.416 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.28 -44.09 97.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.501 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.58 -45.53 90.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.431 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.7 tp10 -66.72 -42.76 85.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.502 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.88 -49.55 74.38 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.728 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -58.94 -40.54 84.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.053 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.66 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.36 -48.82 80.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.682 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.11 -49.31 72.06 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.539 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.6 mt -58.59 -40.62 83.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.145 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.27 -37.37 80.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.981 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.9 mm -63.23 -43.44 98.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.792 179.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.4 ' NE2' ' ND2' ' A' ' 80' ' ' ASN . 99.0 mm-40 -57.14 -45.76 83.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.165 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.94 -49.9 76.08 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.263 0.554 . . . . 0.0 110.133 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -59.53 -44.77 93.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.457 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -61.41 -37.54 83.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -58.45 -47.93 82.38 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.007 0.432 . . . . 0.0 109.864 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 57' ' ' LEU . 32.0 mt -60.75 -42.01 96.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.211 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.25 -48.2 82.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.428 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -56.8 -39.28 73.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.253 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm -59.86 -46.64 88.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -60.6 -45.51 93.71 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.471 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.15 -39.55 92.99 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.99 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -58.66 -42.97 89.66 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.735 ' O ' HD13 ' A' ' 64' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.832 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.56 -38.94 86.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.755 0.312 . . . . 0.0 110.332 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.599 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 55.4 mttp -56.78 -57.57 11.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.004 0.43 . . . . 0.0 110.154 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -53.2 -39.14 63.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.183 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.85 -40.25 92.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.272 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.599 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 88.0 mtm180 -63.35 -39.26 94.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.58 -44.5 93.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -47.24 89.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.381 0.61 . . . . 0.0 110.224 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.615 ' O ' HG23 ' A' ' 83' ' ' VAL . 2.9 ttt180 -61.44 -41.93 97.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.119 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.49 ' O ' HG13 ' A' ' 84' ' ' ILE . 38.6 t30 -61.25 -41.03 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.257 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.688 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.75 -48.69 80.68 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.191 0.52 . . . . 0.0 110.06 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.75 -39.13 87.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.578 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.2 t -63.52 -45.98 96.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.411 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -60.43 -49.01 86.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.354 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.73 -42.82 85.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.965 0.412 . . . . 0.0 111.069 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.62 -45.82 92.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.549 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.66 -47.46 83.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.602 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.83 -22.35 66.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.128 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 77.15 19.81 76.48 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 90' ' ' LEU . 43.8 mt . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.816 0.341 . . . . 0.0 110.422 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.2 mt . . . . . 0 C--O 1.234 0.266 0 CA-C-O 121.005 0.431 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 93.8 mt-10 -61.05 -34.65 75.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.619 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 71.3 mmtt -59.91 -44.07 94.48 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.468 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.12 -44.44 72.39 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.885 0.374 . . . . 0.0 111.69 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.6 ' CZ3' HD22 ' A' ' 135' ' ' LEU . 16.4 t-105 -61.57 -46.69 88.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.847 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.573 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.5 m-70 -68.57 -37.61 80.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.768 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.7 OUTLIER -57.31 -51.92 67.42 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.898 -178.543 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.438 ' HB1' ' HB2' ' A' ' 130' ' ' PHE . . . -73.32 -45.99 52.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.999 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.501 ' HB2' HD11 ' A' ' 135' ' ' LEU . 62.1 tttm -48.54 -44.19 36.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.84 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.8 m -108.62 -63.46 1.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.907 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -54.89 -11.73 0.68 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.598 -178.725 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.56 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -131.76 -3.09 4.19 Favored Glycine 0 CA--C 1.519 0.301 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' SER . 46.5 mttp 54.69 8.71 0.23 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.223 0.535 . . . . 0.0 109.848 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . 0.56 ' CD1' ' O ' ' A' ' 128' ' ' GLY . 14.2 m-30 -67.82 51.19 0.06 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.821 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.553 ' HA ' HD12 ' A' ' 135' ' ' LEU . 96.8 p -97.63 112.29 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.762 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.403 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.94 -97.93 0.59 Allowed Glycine 0 CA--C 1.528 0.871 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.299 178.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.7 mm-40 -77.74 -44.01 29.11 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.042 -179.135 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.4 mp0 -65.6 -43.87 88.35 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.529 -0.469 . . . . 0.0 109.9 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.6 HD22 ' CZ3' ' A' ' 121' ' ' TRP . 0.6 OUTLIER -62.04 -41.4 98.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.886 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -63.67 -36.93 85.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.945 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.2 mttt -63.0 -44.1 96.95 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.418 0.628 . . . . 0.0 110.057 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.02 -42.55 94.59 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -66.07 -37.83 86.79 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.619 -0.718 . . . . 0.0 112.687 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.547 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 0.6 OUTLIER -51.85 -41.64 62.0 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.483 ' N ' ' OE1' ' A' ' 141' ' ' GLU . 0.7 OUTLIER -70.22 -42.42 72.32 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.539 178.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.41 -52.85 63.86 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.209 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.539 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.5 mm? -61.96 -40.64 96.26 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.307 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.547 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 45.2 m170 -53.55 -44.99 69.69 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.474 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.573 ' CE1' HG23 ' A' ' 197' ' ' ILE . 3.4 m-70 -63.83 -41.63 97.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.572 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.6 mmmt -60.27 -41.47 93.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.159 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . 0.472 ' HA ' ' ND1' ' A' ' 150' ' ' HIS . 50.5 mt-10 -70.2 -55.49 9.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.558 -179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -63.52 -44.21 94.93 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.406 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.523 ' CG1' ' N ' ' A' ' 150' ' ' HIS . 2.8 p -60.83 -44.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.438 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' HIS . . . . . 0.696 ' C ' ' CD2' ' A' ' 150' ' ' HIS . 1.2 p-80 -66.15 -33.71 76.4 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.324 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . 0.609 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 91.7 mt-10 -63.33 -39.94 95.94 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.313 -0.555 . . . . 0.0 109.892 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -61.93 -49.4 76.32 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.084 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -68.64 -43.78 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 19.3 t -60.75 -45.07 98.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.096 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.4 mt . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.539 -179.477 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 . . . . . 0 CA--C 1.52 -0.185 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 0.8 OUTLIER -60.98 -45.25 95.55 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.718 179.367 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 191' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 63.3 mttp -70.15 -36.1 74.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 192' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 2.9 tm-20 -68.06 -47.9 67.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.059 0.457 . . . . 0.0 111.741 -178.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.469 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 15.8 pttt -73.13 -41.61 63.78 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.416 -179.219 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.757 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.67 -41.11 79.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.063 -179.59 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 195' ' ' ARG . . . . . 0.535 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 36.1 ptt180 -67.57 -39.12 84.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 67.4 m -58.64 -42.38 88.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 197' ' ' ILE . . . . . 0.573 HG23 ' CE1' ' A' ' 145' ' ' HIS . 91.2 mt -64.14 -43.64 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.429 178.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -61.1 -40.92 95.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.415 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 199' ' ' GLN . . . . . 0.504 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 94.7 mt-30 -60.51 -40.31 90.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.52 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.6 -41.48 99.58 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 197' ' ' ILE . 1.4 mm? -63.24 -41.17 99.04 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.155 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 202' ' ' ASP . . . . . 0.551 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.2 OUTLIER -62.61 -37.39 86.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.41 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 203' ' ' ARG . . . . . 0.459 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 8.0 tmm_? -61.46 -43.85 98.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.731 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.1 mt -61.67 -40.26 94.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -64.85 -42.04 95.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.126 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.744 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -61.43 -45.33 94.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.366 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 207' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.296 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 89.3 p -61.89 -37.33 84.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.543 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -94.33 -43.09 8.57 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.102 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 210' ' ' GLN . . . . . 0.744 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.6 tt0 -87.05 -42.92 12.7 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 211' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . . . . . . 0 CA--C 1.521 0.43 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 220' ' ' GLU . 11.3 tm-20 . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 121.115 0.483 . . . . 0.0 110.292 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 220' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 0.0 OUTLIER 54.78 169.91 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.988 -179.878 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 221' ' ' PRO . . . . . 0.557 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 41.4 Cg_exo -55.85 150.86 43.57 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.461 2.107 . . . . 0.0 112.025 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 222' ' ' ARG . . . . . 0.715 ' O ' ' N ' ' A' ' 225' ' ' ASP . 24.1 ttp180 87.51 -139.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.493 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 223' ' ' VAL . . . . . 0.527 HG23 ' H ' ' A' ' 224' ' ' ILE . 2.5 m 27.77 -104.17 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.207 0.527 . . . . 0.0 110.72 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.527 ' H ' HG23 ' A' ' 223' ' ' VAL . 1.3 mp -59.78 -39.05 78.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.787 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 225' ' ' ASP . . . . . 0.715 ' N ' ' O ' ' A' ' 222' ' ' ARG . 55.9 m-20 -62.53 -40.66 97.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.8 tp -60.0 -43.56 95.11 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.338 0.59 . . . . 0.0 109.491 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 227' ' ' TRP . . . . . 0.433 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 26.0 m0 -63.14 -33.95 76.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.695 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -61.42 -38.95 88.98 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 229' ' ' LEU . . . . . 0.513 ' O ' ' N ' ' A' ' 232' ' ' SER . 97.8 mt -63.44 -42.1 98.66 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.787 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 230' ' ' ALA . . . . . 0.498 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -28.3 -44.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.955 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 231' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 229' ' ' LEU . 8.7 tt0 -67.33 -53.56 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.719 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 232' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 229' ' ' LEU . 30.2 t -68.61 -18.1 64.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.5 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -69.02 -82.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.657 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -177.6 98.81 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.631 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 235' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 235' ' ' LEU . 53.4 mt -145.09 151.62 38.79 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.1 p -79.62 169.25 18.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.691 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -61.38 -48.24 82.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.829 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -60.28 -49.29 78.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.99 0.424 . . . . 0.0 110.817 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.24 -37.52 85.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.675 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.78 -40.57 95.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.43 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.95 -55.6 31.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.612 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -59.39 -37.13 77.19 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.776 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 243' ' ' PHE . . . . . 0.583 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.4 OUTLIER -63.33 -45.92 89.02 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.938 178.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 244' ' ' ARG . . . . . 0.445 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 45.0 ttm180 -60.91 -45.02 96.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.071 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -65.93 -46.56 77.78 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 51.8 tp10 -59.67 -47.42 85.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.583 HD23 ' O ' ' A' ' 243' ' ' PHE . 2.4 mm? -63.73 -39.39 94.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.798 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 86.5 tttt -54.81 -48.1 73.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.165 0.507 . . . . 0.0 110.115 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -67.74 -37.96 82.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -61.05 -49.56 76.88 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.833 0.349 . . . . 0.0 111.066 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 251' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 16.1 pt-20 -62.41 -35.4 79.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.894 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.11 92.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.386 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.29 -50.78 68.76 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.978 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -30.36 49.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.176 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -64.54 -46.39 83.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 110.172 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -62.89 -44.45 96.06 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.349 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -57.61 -42.99 84.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.253 179.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -61.15 -40.79 95.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.133 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 259' ' ' HIS . . . . . 0.533 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 81.9 t60 -59.43 -47.08 86.86 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.27 0.557 . . . . 0.0 110.279 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -62.44 -36.23 81.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.371 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 261' ' ' GLN . . . . . 0.676 HE21 ' CG2' ' A' ' 297' ' ' THR . 83.2 mm-40 -61.71 -42.37 98.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.214 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -60.62 -47.66 85.21 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 263' ' ' GLN . . . . . 0.533 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 3.7 mp0 -65.78 -37.67 86.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.166 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.73 -43.5 98.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.248 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -62.81 -48.93 76.99 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.13 0.49 . . . . 0.0 110.424 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 70.3 mt -62.3 -43.0 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.901 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.54 76.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -63.88 -49.29 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.279 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.75 -44.03 82.53 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.037 0.446 . . . . 0.0 110.672 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -62.39 -45.75 91.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.572 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.54 HD13 ' CB ' ' A' ' 286' ' ' SER . 42.8 tp -62.05 -42.46 99.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.785 0.326 . . . . 0.0 110.344 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -57.25 -42.8 82.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.277 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -80.14 -26.92 39.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.528 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.55 -38.14 90.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.735 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -53.73 -20.91 6.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.548 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 73.5 m -62.37 -37.18 84.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.73 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.0 t -61.01 -45.22 98.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.49 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 98.74 17.78 27.24 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 279' ' ' ASP . . . . . 0.424 ' O ' HG23 ' A' ' 283' ' ' VAL . 99.8 m-20 -82.5 106.63 14.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.823 0.344 . . . . 0.0 110.462 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.21 91.8 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -61.63 -53.93 49.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.769 0.319 . . . . 0.0 110.632 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -68.2 -43.88 77.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.778 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 283' ' ' VAL . . . . . 0.577 ' CG1' ' NH1' ' A' ' 287' ' ' ARG . 41.8 t -61.85 -48.28 89.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.701 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 42.9 t -62.99 -46.04 89.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.777 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -63.25 -41.33 99.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.788 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 286' ' ' SER . . . . . 0.54 ' CB ' HD13 ' A' ' 271' ' ' LEU . 55.4 m -59.64 -45.3 92.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.398 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 287' ' ' ARG . . . . . 0.577 ' NH1' ' CG1' ' A' ' 283' ' ' VAL . 59.6 mtt85 -64.03 -38.16 90.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.975 0.417 . . . . 0.0 110.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -57.76 -60.98 2.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.393 0.616 . . . . 0.0 110.238 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 289' ' ' LYS . . . . . 0.513 ' HD3' HD23 ' A' ' 292' ' ' LEU . 4.9 mmtp -63.34 -40.46 97.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.043 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -42.62 -52.49 4.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.182 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.09 -37.63 78.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.677 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 292' ' ' LEU . . . . . 0.513 HD23 ' HD3' ' A' ' 289' ' ' LYS . 22.8 tp -61.41 -52.28 65.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.587 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.83 -42.05 97.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.251 0.548 . . . . 0.0 109.991 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 294' ' ' GLU . . . . . 0.502 ' O ' ' OG1' ' A' ' 297' ' ' THR . 82.3 tt0 -62.25 -35.34 78.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.695 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.47 -44.81 94.69 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -59.58 -43.48 93.63 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.09 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 297' ' ' THR . . . . . 0.676 ' CG2' HE21 ' A' ' 261' ' ' GLN . 36.0 p -60.5 -42.19 95.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.243 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -63.73 -45.12 91.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.434 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -60.92 -44.15 97.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.305 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -42.74 99.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.962 0.411 . . . . 0.0 110.429 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.28 -43.23 95.66 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -62.15 -42.86 99.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.399 . . . . 0.0 110.449 178.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 10.5 m -61.25 -44.96 96.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.482 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.56 -43.27 90.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.972 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -59.33 -49.6 77.2 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.626 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -62.9 -43.56 98.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.341 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 307' ' ' HIS . . . . . 0.538 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.58 -37.05 85.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.138 179.321 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 308' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 312' ' ' SER . 11.8 mt -61.34 -41.87 97.75 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.436 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -68.52 -58.84 3.71 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.05 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.11 -48.79 78.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.265 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 311' ' ' LEU . . . . . 0.561 HD12 ' NH2' ' A' ' 314' ' ' ARG . 12.4 tp -61.0 -42.78 99.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.703 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 312' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 67.2 p -61.67 -36.11 79.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.519 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.26 -44.96 89.69 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 314' ' ' ARG . . . . . 0.561 ' NH2' HD12 ' A' ' 311' ' ' LEU . 87.0 mtm180 -63.2 -43.46 98.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.738 0.304 . . . . 0.0 110.855 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 315' ' ' ILE . . . . . 0.442 ' O ' HG22 ' A' ' 315' ' ' ILE . 2.1 mm -74.09 -15.79 16.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.692 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 6.1 t -53.49 -48.65 68.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.262 0.553 . . . . 0.0 109.726 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.76 -176.867 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 88.0 t80 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 t -61.27 -44.09 97.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.069 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 54.5 ttm-85 55.31 78.39 0.19 Allowed 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.648 ' O ' ' N ' ' A' ' 6' ' ' ASN . 96.7 mt-10 -61.99 -32.96 73.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.894 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.6 tttp 48.26 -79.08 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.602 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.648 ' N ' ' O ' ' A' ' 4' ' ' GLU . 0.6 OUTLIER -149.83 166.81 28.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.648 0.261 . . . . 0.0 110.375 179.669 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -176.36 58.75 0.17 Allowed Pre-proline 0 N--CA 1.463 0.179 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.769 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.63 148.18 92.41 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 122.367 2.045 . . . . 0.0 111.915 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.5 tttt -171.24 56.55 0.24 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.594 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.22 155.87 63.45 Favored 'Trans proline' 0 C--N 1.308 -1.593 0 C-N-CA 122.655 2.237 . . . . 0.0 112.08 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.7 p -45.72 142.72 3.44 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.684 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.13 149.7 36.56 Favored 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 122.694 2.262 . . . . 0.0 112.043 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -139.16 147.64 42.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.438 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 40.88 80.37 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.063 0.459 . . . . 0.0 110.68 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -73.63 2.46 8.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.441 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 30.9 p -154.26 160.22 41.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.611 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 175.42 175.83 43.18 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.936 -0.865 . . . . 0.0 110.936 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -86.88 129.31 34.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.788 0.328 . . . . 0.0 110.529 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -89.02 -64.69 1.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.784 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -93.81 153.35 18.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.52 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.485 ' C ' ' SD ' ' A' ' 22' ' ' MET . 73.2 ttp85 -67.77 -18.68 64.95 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.525 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.486 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -115.32 137.14 52.35 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.206 0.526 . . . . 0.0 111.102 -179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.94 -36.49 84.55 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.474 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.602 ' HA ' HE21 ' A' ' 27' ' ' GLN . 63.9 tttp -60.72 -47.35 86.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.106 0.479 . . . . 0.0 110.26 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.7 mp -61.77 -38.25 87.35 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.486 ' ND2' ' O ' ' A' ' 22' ' ' MET . 57.7 m-80 -62.32 -40.69 97.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.972 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.602 HE21 ' HA ' ' A' ' 24' ' ' LYS . 34.3 mt-30 -60.84 -45.7 93.48 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.722 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.22 -41.03 96.15 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.032 0.444 . . . . 0.0 109.973 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -57.96 -44.71 87.2 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.121 0.486 . . . . 0.0 109.787 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -60.48 -37.46 81.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.616 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 73.5 mmtt -61.38 -42.53 98.87 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.255 0.55 . . . . 0.0 109.678 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.72 -37.31 86.05 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.149 -0.621 . . . . 0.0 110.113 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -61.15 -46.37 90.82 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.254 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.616 ' HG2' ' O ' ' A' ' 31' ' ' LYS . 53.6 ptt85 -66.19 -35.1 79.57 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.119 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.36 -38.63 91.91 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.051 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.77 110.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.707 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 mt -132.69 154.59 81.54 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.741 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 79.0 Cg_exo -42.54 154.3 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.415 2.077 . . . . 0.0 112.487 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.1 Cg_exo -58.12 -46.86 22.87 Favored 'Trans proline' 0 N--CA 1.497 1.73 0 C-N-CA 122.615 2.21 . . . . 0.0 112.51 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.472 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 62.2 t -64.14 -46.46 93.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.726 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -64.06 -41.86 97.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.133 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.97 -44.2 97.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.61 90.47 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.71 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.472 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 1.7 mp0 -67.73 -46.94 70.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.84 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.533 HD13 ' OH ' ' A' ' 88' ' ' TYR . 55.6 tp -63.16 -46.92 84.91 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.023 0.44 . . . . 0.0 110.489 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -59.27 -42.32 90.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.05 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.578 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.62 -47.64 84.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.939 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -56.01 -47.13 78.34 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.68 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.32 -40.86 87.61 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -59.4 -39.34 83.1 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.842 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 47' ' ' ALA . 40.6 mm -62.33 -43.7 98.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -55.5 -44.71 76.84 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.267 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -60.08 -46.53 89.28 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.088 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -60.66 -44.48 96.38 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.364 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -61.07 -37.45 82.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.311 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -60.44 -45.1 94.89 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.26 -42.01 97.9 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.213 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.54 94.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.014 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -58.6 -43.53 89.59 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.759 0.314 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -60.2 -46.57 89.26 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.012 0.434 . . . . 0.0 110.044 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -63.79 -39.57 94.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.786 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.6 mt -61.57 -43.17 99.36 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.27 -37.02 85.99 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.13 -44.91 96.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.907 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.47 -36.84 85.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.134 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.63 71.56 0.99 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 88.4 mt -131.75 -54.14 1.0 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.757 0.313 . . . . 0.0 110.814 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 48.6 p-10 -58.58 141.36 52.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.453 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -148.17 -49.78 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.621 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -65.51 -29.38 70.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.55 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.99 11.82 80.68 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.681 -0.967 . . . . 0.0 110.681 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -64.05 -34.75 78.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.37 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.1 -50.1 75.35 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.088 0.47 . . . . 0.0 109.857 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -61.4 -41.89 97.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.188 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.23 89.85 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.382 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -62.5 -42.74 99.71 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.642 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.16 -43.45 98.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.522 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.9 -44.53 98.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 121.094 0.473 . . . . 0.0 109.966 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.758 ' O ' HG23 ' A' ' 83' ' ' VAL . 20.7 mmm180 -59.87 -41.12 90.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.098 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.78 -39.34 94.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.39 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.582 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.43 -49.14 78.95 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.39 -179.58 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -64.31 -39.02 93.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.512 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 79' ' ' ARG . 70.7 t -62.18 -46.21 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.835 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.7 mt -61.53 -47.66 92.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.183 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.3 -39.63 92.74 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.648 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.49 93.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.545 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.66 -44.54 96.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.693 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.533 ' OH ' HD13 ' A' ' 45' ' ' LEU . 12.2 m-85 -69.49 -26.0 64.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.32 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.03 28.07 71.05 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 85.4 mt -96.59 6.62 48.34 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.898 0.38 . . . . 0.0 110.68 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -73.25 54.9 0.43 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.225 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.57 140.78 23.04 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -150.26 151.75 33.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.699 0.285 . . . . 0.0 110.625 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -139.52 146.69 40.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.318 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -69.19 141.78 54.44 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.414 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.41 ' O ' ' O ' ' A' ' 97' ' ' ARG . . . -164.3 -47.6 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.71 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.41 ' O ' ' O ' ' A' ' 96' ' ' ALA . 59.6 ttm-85 45.91 96.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.641 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -53.09 165.34 0.32 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.778 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 74.3 t -61.95 -45.38 98.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.442 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.438 HG22 ' H ' ' A' ' 100' ' ' THR . 0.0 OUTLIER -80.74 160.09 25.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.557 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.7 t -155.09 155.69 34.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.562 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.414 ' C ' ' N ' ' A' ' 104' ' ' LEU . 88.7 m-20 -62.83 -41.23 99.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.529 ' O ' ' OG ' ' A' ' 103' ' ' SER . 0.3 OUTLIER 45.51 21.32 0.07 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.978 0.418 . . . . 0.0 110.436 179.684 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.475 HD13 ' C ' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -76.96 -72.02 0.37 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.76 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.4 ' O ' ' O ' ' A' ' 104' ' ' LEU . 0.7 OUTLIER 60.11 145.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.692 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 161.18 66.34 0.02 OUTLIER Glycine 0 CA--C 1.523 0.592 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.7 t -140.08 -171.77 3.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.85 0.357 . . . . 0.0 110.527 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -62.68 136.27 57.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.876 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -85.54 126.57 33.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.282 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -149.03 159.73 43.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.608 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -171.07 -69.9 0.04 OUTLIER Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 27.6 mt -116.67 131.16 57.02 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.736 0.303 . . . . 0.0 110.234 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -122.19 -40.64 2.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.742 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -83.0 124.87 76.2 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.635 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -51.53 -38.37 64.43 Favored 'Trans proline' 0 N--CA 1.495 1.605 0 C-N-CA 122.367 2.045 . . . . 0.0 112.469 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.461 ' HG3' ' H ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.36 -42.65 96.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.948 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.461 ' H ' ' HG3' ' A' ' 116' ' ' ARG . 98.3 mt -64.93 -39.74 93.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.976 0.417 . . . . 0.0 110.227 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.5 mt-10 -62.13 -30.39 71.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.579 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.1 mttt -62.93 -50.45 70.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.747 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 120' ' ' LEU . 32.5 mt -68.08 -43.83 77.63 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.882 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.0 t-105 -60.41 -51.3 70.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 -179.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.524 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -70.08 -37.55 75.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.026 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.759 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.5 OUTLIER -55.45 -50.87 68.71 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.463 -178.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.95 ' HB1' ' CG ' ' A' ' 130' ' ' PHE . . . -72.5 -46.93 52.4 Favored 'General case' 0 C--O 1.246 0.886 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.288 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.404 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 55.8 tttm -47.15 -33.91 5.64 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.46 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -106.15 -35.43 7.22 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.986 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.576 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 36.9 m -50.72 -24.84 3.69 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.279 -178.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -153.89 -95.8 0.12 Allowed Glycine 0 CA--C 1.525 0.703 0 C-N-CA 119.686 -1.245 . . . . 0.0 111.824 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.738 ' O ' ' N ' ' A' ' 131' ' ' SER . 68.8 mttm -150.93 25.27 0.74 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.372 0.605 . . . . 0.0 110.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.95 ' CG ' ' HB1' ' A' ' 124' ' ' ALA . 21.9 m-85 -49.72 60.82 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.186 -1.37 . . . . 0.0 111.14 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.738 ' N ' ' O ' ' A' ' 129' ' ' LYS . 30.3 p -70.1 146.44 50.89 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.446 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . -37.03 -18.56 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.178 -173.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.632 ' N ' ' O ' ' A' ' 131' ' ' SER . 48.8 mt-10 -74.31 -46.14 42.9 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 118.927 -1.109 . . . . 0.0 108.497 176.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' A' ' 131' ' ' SER . 80.4 mm-40 -75.62 -42.36 51.85 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.354 178.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.882 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -60.07 -37.47 79.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.446 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 54.5 m-20 -61.92 -43.94 97.8 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.362 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -58.92 -45.16 91.05 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 119.881 -0.727 . . . . 0.0 109.9 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.489 HD13 ' OE2' ' A' ' 141' ' ' GLU . 4.5 mm? -61.01 -40.37 93.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 178.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.591 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -65.12 -31.53 72.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 176.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.567 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 84.5 mmt-85 -57.6 -48.51 79.19 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.245 -0.982 . . . . 0.0 108.358 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.83 ' OE1' HD21 ' A' ' 204' ' ' LEU . 9.4 pt-20 -71.46 -34.16 69.98 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.964 -0.694 . . . . 0.0 111.912 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.591 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.2 m-85 -56.15 -58.78 6.48 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 121.184 0.516 . . . . 0.0 110.242 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.41 -37.59 86.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.214 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 67.4 m170 -51.51 -42.7 61.9 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 119.677 -0.809 . . . . 0.0 109.388 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.88 -41.67 91.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.396 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -61.29 -44.15 97.7 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.31 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -68.05 -49.19 62.9 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -61.37 -42.91 99.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.606 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.06 -45.09 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.542 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.689 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.4 m170 -61.12 -35.96 78.45 Favored 'General case' 0 C--O 1.215 -0.742 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.294 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -65.21 -46.68 79.69 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.191 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.416 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 42.1 m-85 -65.69 -44.02 87.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.837 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -70.44 -45.2 66.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.667 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 150' ' ' HIS . 75.9 t -63.12 -45.96 97.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.905 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.72 -43.74 95.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.42 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.08 -43.59 98.12 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.588 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.449 ' O ' ' OG ' ' A' ' 160' ' ' SER . 79.5 mm-40 -67.6 -28.29 67.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.984 0.421 . . . . 0.0 110.037 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 63.0 m -67.88 -49.53 61.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.88 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.593 HD22 HH22 ' A' ' 186' ' ' ARG . 4.2 pp -79.33 -20.78 47.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.756 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.523 ' N ' HD12 ' A' ' 159' ' ' LEU . 80.4 p -60.44 -34.65 74.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.45 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.427 ' C ' ' H ' ' A' ' 163' ' ' GLU . 99.4 mtt180 -63.58 -40.75 97.75 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.101 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 11.5 p -75.49 39.73 0.16 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.643 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.427 ' H ' ' C ' ' A' ' 161' ' ' ARG . 71.3 mm-40 -127.02 -39.34 1.94 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.051 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.469 ' OE2' ' OE1' ' A' ' 167' ' ' GLU . 11.7 tp10 -89.94 23.48 2.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.157 0.504 . . . . 0.0 110.289 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.598 HG23 ' O ' ' A' ' 165' ' ' ILE . 18.8 tt -56.6 117.26 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.056 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 34.8 m170 54.1 23.57 4.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.366 0.603 . . . . 0.0 109.465 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.469 ' OE1' ' OE2' ' A' ' 164' ' ' GLU . 48.5 tp10 45.73 81.95 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.784 178.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.455 ' O ' HG13 ' A' ' 169' ' ' VAL . 80.6 m-20 -158.86 112.42 2.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.137 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 168' ' ' ASN . 6.0 m -154.48 75.14 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.76 0.314 . . . . 0.0 110.963 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 21.4 tt -172.34 135.42 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.548 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . 0.599 ' O ' ' N ' ' A' ' 173' ' ' SER . 5.8 m -159.83 155.53 22.61 Favored Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.606 179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.55 65.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 122.545 2.163 . . . . 0.0 112.311 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.599 ' N ' ' O ' ' A' ' 171' ' ' SER . 16.7 m -145.32 123.79 12.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.754 0.311 . . . . 0.0 110.711 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.574 ' OD1' ' N ' ' A' ' 175' ' ' LEU . 46.6 p-10 -65.3 -37.23 86.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.413 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.574 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 0.9 OUTLIER -142.79 45.85 1.58 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.038 0.447 . . . . 0.0 109.938 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 6.2 m 57.66 -86.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.231 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.522 ' N ' ' OD1' ' A' ' 177' ' ' ASP . 13.1 p-10 174.64 123.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.675 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.438 ' N ' HD13 ' A' ' 178' ' ' ILE . 0.0 OUTLIER -126.81 128.4 70.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.833 0.349 . . . . 0.0 110.655 179.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -124.47 5.38 8.32 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.777 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.417 ' O ' HG23 ' A' ' 182' ' ' VAL . . . 109.05 126.7 5.37 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.807 ' N ' ' NE2' ' A' ' 184' ' ' HIS . 3.1 t 56.56 56.37 5.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.88 0.371 . . . . 0.0 110.189 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 180' ' ' GLY . 6.2 t -138.87 -85.13 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.92 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 50.6 tp -93.01 -48.25 6.6 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.975 0.417 . . . . 0.0 111.258 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.807 ' NE2' ' N ' ' A' ' 181' ' ' SER . 23.8 p80 -53.3 -39.43 63.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.204 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -43.92 96.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.583 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.593 HH22 HD22 ' A' ' 159' ' ' LEU . 3.7 tpt180 -61.21 -45.21 95.51 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.588 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 -61.72 -40.51 95.33 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.423 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 59.3 m -61.61 -44.22 97.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.174 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -63.06 -37.7 88.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.967 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.588 HD23 ' NZ ' ' A' ' 193' ' ' LYS . 8.5 mt -61.97 -47.85 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.592 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.465 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.7 mtpt -68.59 -40.88 80.32 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.438 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -68.76 -44.95 72.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.883 -178.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.588 ' NZ ' HD23 ' A' ' 190' ' ' LEU . 1.8 pttm -71.57 -44.46 64.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.233 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -69.36 -42.82 74.72 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.32 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.548 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.99 -37.56 88.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' ' 195' ' ' ARG . 69.3 m -62.18 -44.32 96.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -65.38 -43.71 94.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.983 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -63.06 -42.47 99.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.822 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -66.04 -33.12 75.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.334 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.95 -49.51 74.83 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.452 ' HA ' HD23 ' A' ' 201' ' ' LEU . 23.0 mt -63.49 -40.46 97.15 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.961 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.8 -37.41 84.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -42.83 99.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.238 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.83 HD21 ' OE1' ' A' ' 141' ' ' GLU . 21.0 mt -61.51 -41.48 97.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -64.52 -42.94 95.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.803 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.711 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -65.99 -40.29 91.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.565 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.521 ' O ' ' N ' ' A' ' 211' ' ' GLY . 22.0 t -63.65 -46.82 93.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.86 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.8 p -72.07 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.058 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -100.5 -14.76 18.12 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.318 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.711 ' N ' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -130.75 -39.53 1.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.045 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -75.6 49.76 2.42 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.029 -0.828 . . . . 0.0 111.029 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.522 ' OH ' ' C ' ' A' ' 127' ' ' SER . 0.8 OUTLIER -118.57 -170.37 1.89 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.933 0.397 . . . . 0.0 110.638 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 82.5 p -60.08 146.52 42.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.139 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 40.7 p -126.94 -177.59 4.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.384 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.441 ' HG2' ' N ' ' A' ' 216' ' ' ALA . 80.8 tt0 65.22 159.14 0.11 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.182 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . 0.441 ' N ' ' HG2' ' A' ' 215' ' ' GLU . . . -56.94 138.83 53.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.682 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -77.35 -14.8 59.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.906 0.384 . . . . 0.0 110.54 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.573 ' O ' ' N ' ' A' ' 220' ' ' GLU . 82.2 m-85 -132.85 -105.3 0.25 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.9 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 219' ' ' GLU . 73.8 tt0 31.0 32.9 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.72 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 218' ' ' PHE . 12.4 mt-10 -61.33 139.86 94.66 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.521 -179.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.425 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 68.9 Cg_endo -76.88 14.63 1.25 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.582 2.188 . . . . 0.0 111.919 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -105.94 -62.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.319 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.494 HG13 ' H ' ' A' ' 224' ' ' ILE . 0.5 OUTLIER -61.11 -55.31 25.48 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 CA-C-O 121.073 0.464 . . . . 0.0 111.619 -179.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.494 ' H ' HG13 ' A' ' 223' ' ' VAL . 2.9 mm -62.75 -41.5 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 47.8 t0 -62.58 -37.7 87.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.95 0.405 . . . . 0.0 109.938 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 6.0 tp -60.19 -43.49 95.84 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.449 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 46.2 m0 -60.26 -38.63 84.11 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.054 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . 0.511 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 45.1 t0 -61.64 -33.83 74.63 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 178.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.647 ' O ' ' N ' ' A' ' 232' ' ' SER . 38.6 mt -64.32 -40.08 95.19 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.071 0.463 . . . . 0.0 110.695 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.521 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -24.58 -51.77 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.092 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.511 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 2.3 pt20 -58.27 -44.81 88.57 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.232 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.647 ' N ' ' O ' ' A' ' 229' ' ' LEU . 9.9 m -79.97 -7.54 58.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.377 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -81.91 10.73 5.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.928 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 1.6 m120 67.56 91.28 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.31 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 79.7 mt -129.73 166.34 20.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.701 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.0 p -73.46 161.56 30.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.722 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -63.99 -46.28 85.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.57 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -62.68 -46.71 86.92 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.993 0.425 . . . . 0.0 110.524 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -67.44 -37.96 83.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.557 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -63.07 -42.58 99.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.731 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -64.77 -52.83 54.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.522 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.59 -37.77 76.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.468 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -66.7 -44.14 82.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.853 178.789 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -57.3 -47.93 80.22 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.902 0.382 . . . . 0.0 110.264 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.96 -38.81 83.22 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.814 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -60.02 -49.6 77.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.944 0.402 . . . . 0.0 110.492 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.505 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 4.0 mm? -63.78 -40.33 96.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.976 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.5 -44.25 84.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.923 0.392 . . . . 0.0 110.037 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -67.01 -41.16 87.17 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.714 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -59.4 -48.89 79.9 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 120.739 0.304 . . . . 0.0 111.282 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 12.4 pt-20 -65.1 -37.65 88.17 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.76 -40.08 88.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.743 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -62.85 -45.39 92.78 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.428 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -65.05 -40.3 88.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.079 -0.649 . . . . 0.0 109.832 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.81 -44.56 96.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -61.82 -42.41 98.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.102 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -56.11 -45.49 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.24 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . 0.401 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 53.8 t-20 -59.13 -41.95 89.47 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.362 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -59.02 -45.52 90.5 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.371 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -62.18 -38.26 88.41 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.148 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.503 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 61.4 mm-40 -59.7 -42.28 92.64 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.049 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -62.07 -47.74 83.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.419 -0.513 . . . . 0.0 109.848 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -65.24 -34.09 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.111 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.43 -42.13 99.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.89 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -64.19 -47.6 79.13 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.05 -43.42 99.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.1 -38.17 82.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.975 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.82 -44.29 97.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.955 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . 0.543 ' OE2' ' NE2' ' A' ' 273' ' ' HIS . 17.3 tp10 -59.83 -44.84 93.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.136 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.09 -39.43 89.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 28.3 tp -60.3 -44.75 95.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.072 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . 0.425 ' NH2' ' OE1' ' A' ' 269' ' ' GLU . 86.6 mtm180 -61.15 -42.07 97.89 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.095 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . 0.543 ' NE2' ' OE2' ' A' ' 269' ' ' GLU . 18.1 m170 -67.85 -43.09 80.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.214 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.64 84.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.886 0.374 . . . . 0.0 110.939 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -64.3 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 7.8 t -61.95 -20.44 63.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.78 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.458 HG12 ' H ' ' A' ' 279' ' ' ASP . 91.5 t -61.3 -46.26 96.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.884 0.373 . . . . 0.0 110.413 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.72 58.04 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . 0.458 ' H ' HG12 ' A' ' 277' ' ' VAL . 91.1 m-20 -68.07 -24.06 65.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.602 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 83.78 5.74 87.73 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . 0.681 ' C ' ' H ' ' A' ' 283' ' ' VAL . 75.0 mm-40 -82.91 156.92 23.28 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.994 0.426 . . . . 0.0 110.026 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 61.2 -17.8 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.732 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . 0.681 ' H ' ' C ' ' A' ' 281' ' ' GLU . 73.7 t -63.25 -47.4 92.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.837 0.351 . . . . 0.0 110.66 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 5.9 t -64.3 -46.22 84.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.485 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -62.96 -46.25 88.62 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.927 0.394 . . . . 0.0 110.79 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 m -61.58 -42.09 98.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.529 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -64.32 -39.03 93.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.38 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -60.71 -55.3 34.84 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.751 ' HD3' HD23 ' A' ' 292' ' ' LEU . 8.1 mmtp -64.02 -32.8 74.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.375 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . 0.572 ' CE1' ' OE2' ' A' ' 294' ' ' GLU . 19.9 t-80 -57.82 -49.86 75.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.351 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.27 -39.12 82.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.746 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.751 HD23 ' HD3' ' A' ' 289' ' ' LYS . 4.4 tp -61.5 -47.13 87.02 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.341 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 1.1 mt -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.058 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.572 ' OE2' ' CE1' ' A' ' 290' ' ' HIS . 92.1 mt-10 -64.2 -36.14 83.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.12 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.92 89.42 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . 0.521 ' NH1' ' OE1' ' A' ' 299' ' ' GLU . 14.2 tpp180 -62.81 -42.7 99.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.682 0.277 . . . . 0.0 110.744 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.503 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 23.4 p -59.06 -50.04 75.61 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.427 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -63.07 -43.2 99.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.529 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . 0.521 ' OE1' ' NH1' ' A' ' 296' ' ' ARG . 83.6 tt0 -62.0 -40.54 96.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.294 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.61 95.64 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.267 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.65 -41.59 97.46 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . 0.469 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 70.1 t80 -62.15 -45.54 92.96 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.53 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 8.9 m -60.44 -43.4 96.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.447 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.97 -43.25 91.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 52.0 tttp -56.32 -50.41 71.55 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.342 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . 0.469 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 30.9 mtpt -62.78 -42.35 99.66 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.49 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -61.78 -37.97 86.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.449 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 9.4 mt -61.02 -44.61 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.277 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -68.96 -45.69 70.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.068 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -62.73 -52.07 64.68 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.536 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.04 -38.7 91.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.504 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.0 m -58.38 -44.61 88.99 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.381 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -73.06 -47.28 24.83 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.135 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -63.6 -45.44 90.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.743 0.306 . . . . 0.0 110.521 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.551 ' O ' ' C ' ' A' ' 316' ' ' SER . 2.5 mm -70.48 -27.02 29.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.576 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . 0.551 ' C ' ' O ' ' A' ' 315' ' ' ILE . 23.1 t -37.15 -48.62 0.84 Allowed 'General case' 0 CA--C 1.486 -1.517 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.452 ' O ' ' N ' ' A' ' 319' ' ' ARG . 59.1 ttt85 -158.31 124.1 4.54 Favored 'General case' 0 N--CA 1.428 -1.557 0 C-N-CA 116.297 -2.161 . . . . 0.0 113.249 173.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.536 ' HA ' HD11 ' A' ' 323' ' ' LEU . . . -74.32 68.95 1.56 Allowed 'General case' 0 N--CA 1.403 -2.785 0 N-CA-C 102.873 -3.01 . . . . 0.0 102.873 175.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 317' ' ' ARG . 12.0 ptm180 -89.85 -37.46 14.43 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.78 -174.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . 0.636 ' O ' ' N ' ' A' ' 323' ' ' LEU . 0.3 OUTLIER -93.6 70.65 4.21 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.508 178.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 31.24 -102.69 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.861 -1.063 . . . . 0.0 112.859 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 25.4 mp0 -79.82 8.16 7.32 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 118.122 -1.431 . . . . 0.0 111.517 -178.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.636 ' N ' ' O ' ' A' ' 320' ' ' HIS . 14.8 mt . . . . . 0 C--O 1.221 -0.403 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.598 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.0 p -69.72 -14.51 62.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.69 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 55.49 80.97 0.12 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.505 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -134.46 21.39 3.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.627 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -71.91 139.53 48.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.68 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -162.79 75.19 0.41 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.53 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.479 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 1.5 mp0 -76.15 -54.94 1.9 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.822 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 7' ' ' GLN . 97.8 Cg_exo -37.75 134.73 0.57 Allowed 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.53 2.153 . . . . 0.0 111.893 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.713 ' H ' ' HD2' ' A' ' 10' ' ' PRO . 8.2 tttt -121.72 -47.93 0.04 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.977 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.713 ' HD2' ' H ' ' A' ' 9' ' ' LYS . 73.0 Cg_endo -83.07 101.66 1.02 Allowed 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.413 2.076 . . . . 0.0 112.325 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.469 ' O ' ' O ' ' A' ' 10' ' ' PRO . 3.1 m 57.92 146.01 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.62 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -69.29 149.61 70.11 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.447 2.098 . . . . 0.0 112.119 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -81.48 120.37 24.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.295 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -167.52 177.19 6.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.651 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -80.62 67.95 6.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.452 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 p -80.38 163.77 23.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.685 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 158.14 42.29 0.02 OUTLIER Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -162.01 123.08 2.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.722 0.296 . . . . 0.0 110.622 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.1 tp10 -131.28 -36.59 1.28 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.517 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.548 ' H ' ' CG ' ' A' ' 26' ' ' ASN . 33.5 m-85 -91.31 -178.72 5.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.19 -19.1 61.79 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.826 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.463 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 99.2 mmm -135.1 148.0 49.69 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.242 0.544 . . . . 0.0 110.916 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -64.36 -37.16 86.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.486 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.7 -48.59 80.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.117 0.484 . . . . 0.0 110.45 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.16 -38.32 86.03 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.496 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.548 ' CG ' ' H ' ' A' ' 20' ' ' PHE . 58.1 m-80 -63.27 -39.94 95.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.196 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -61.65 -43.9 97.98 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.282 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 2.3 mm? -62.6 -43.17 99.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.427 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.514 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 48.0 t-105 -63.01 -50.63 69.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.469 0.652 . . . . 0.0 110.346 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -56.91 -39.05 73.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.846 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.4 ttmt -61.07 -44.37 97.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.024 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.82 88.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.806 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.622 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 76.1 mt-30 -61.14 -38.24 85.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.946 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 mmm-85 -64.12 -39.27 93.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.545 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 35' ' ' LEU . 88.8 mt -66.04 -32.54 74.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.397 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.622 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 32.6 m170 65.86 113.87 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.752 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.2 mt -138.38 154.49 73.68 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.753 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -42.01 154.6 0.1 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.454 2.102 . . . . 0.0 112.321 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -69.41 -40.35 5.99 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.548 2.165 . . . . 0.0 112.454 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 63.1 t -63.21 -48.92 85.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.578 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -66.31 -39.42 89.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.447 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.26 -41.84 99.08 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.552 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.44 78.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.52 -42.63 87.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.9 tp -62.45 -47.46 83.94 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.152 0.501 . . . . 0.0 110.748 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.03 -41.57 96.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.273 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.565 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.16 -48.37 81.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.727 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -54.11 -48.5 70.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.865 0.364 . . . . 0.0 110.251 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.82 -40.07 83.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -59.94 -40.01 87.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.565 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.3 mm -62.53 -42.9 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.81 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.453 HE22 HD22 ' A' ' 81' ' ' LEU . 48.0 tt0 -59.67 -45.49 91.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.351 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -57.4 -48.0 80.22 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.346 0.593 . . . . 0.0 110.114 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -59.57 -43.97 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.311 0.577 . . . . 0.0 110.267 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -60.67 -40.16 91.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -58.29 -46.03 86.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.194 0.521 . . . . 0.0 109.848 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.87 -42.63 94.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.998 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.87 -45.2 95.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.549 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 82.2 t90 -56.09 -42.53 76.89 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.283 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.3 -45.95 91.58 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.205 0.526 . . . . 0.0 109.715 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -57.1 -44.63 83.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.11 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.3 mp -62.37 -40.11 95.36 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.021 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -56.46 -44.67 80.77 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 27.0 mt -62.15 -41.67 98.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.254 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -63.97 -36.13 82.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.074 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.4 69.7 1.05 Allowed Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.276 -0.729 . . . . 0.0 111.276 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 80.5 mt -127.09 -54.17 1.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.762 0.315 . . . . 0.0 110.842 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -71.48 126.69 30.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.489 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -124.76 -52.37 1.68 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.559 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -66.93 -32.86 74.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.483 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.49 18.14 53.13 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -59.69 -39.1 83.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.841 0.353 . . . . 0.0 110.201 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -56.93 -64.26 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.079 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -48.0 -40.38 22.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.216 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.33 86.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.225 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.7 ttt85 -61.34 -41.1 96.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.442 HD12 ' N ' ' A' ' 77' ' ' LEU . 11.0 mp -61.89 -44.15 97.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.146 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.41 -45.77 92.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.293 0.568 . . . . 0.0 109.97 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.821 ' O ' HG23 ' A' ' 83' ' ' VAL . 40.7 mmm-85 -61.79 -38.9 89.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.962 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.4 ' O ' HG13 ' A' ' 84' ' ' ILE . 38.0 t30 -64.02 -40.48 96.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.185 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.563 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -59.64 -49.86 76.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.311 0.577 . . . . 0.0 109.97 -179.392 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -66.17 -37.51 85.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.549 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.821 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.4 t -62.52 -46.57 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.653 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 80' ' ' ASN . 80.4 mt -61.35 -46.95 95.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.391 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 85' ' ' LEU . 29.6 mt -65.31 -39.35 92.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.911 0.386 . . . . 0.0 110.555 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.34 -48.21 82.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.866 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.405 ' HZ2' HG13 ' A' ' 83' ' ' VAL . 47.3 mttp -62.73 -45.33 93.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.776 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -64.35 -30.21 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.376 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.31 9.67 83.41 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 90' ' ' LEU . 95.8 mt -90.78 1.79 56.6 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.811 0.338 . . . . 0.0 110.349 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.425 ' CG ' ' N ' ' A' ' 92' ' ' GLY . 16.4 p-10 -61.37 -49.77 75.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.772 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.425 ' N ' ' CG ' ' A' ' 91' ' ' ASP . . . 158.85 -161.0 31.58 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.48 ' HG2' ' H ' ' A' ' 95' ' ' ASP . 82.9 tttt -140.17 144.94 36.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 0.0 110.409 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -132.29 37.75 3.52 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.582 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.48 ' H ' ' HG2' ' A' ' 93' ' ' LYS . 47.6 m-20 59.98 113.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.56 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -149.03 141.24 24.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.407 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.706 ' O ' ' N ' ' A' ' 99' ' ' VAL . 83.3 mtp180 -63.08 -45.2 93.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.666 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 55.19 -65.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.073 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.706 ' N ' ' O ' ' A' ' 97' ' ' ARG . 3.3 m -97.14 131.77 43.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.235 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.21 -7.2 22.36 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.484 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.592 ' O ' ' CG ' ' A' ' 102' ' ' ASN . 42.4 t -61.29 -41.75 97.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.494 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.592 ' CG ' ' O ' ' A' ' 101' ' ' SER . 16.8 p30 51.84 41.13 29.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.716 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.497 ' O ' ' O ' ' A' ' 104' ' ' LEU . 2.3 p -136.84 139.2 41.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.31 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.497 ' O ' ' O ' ' A' ' 103' ' ' SER . 4.1 mm? 55.78 152.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.319 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 88.3 p -62.88 -22.22 66.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.699 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.07 11.47 78.65 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.2 p -66.92 111.86 4.01 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -141.73 174.21 10.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.34 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 61.67 71.31 0.55 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.905 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -149.92 93.81 2.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.342 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.561 ' C ' HD22 ' A' ' 112' ' ' LEU . . . -125.39 -120.26 2.43 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.771 -0.931 . . . . 0.0 110.771 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.561 HD22 ' C ' ' A' ' 111' ' ' GLY . 4.4 mm? -109.6 128.46 55.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.051 0.453 . . . . 0.0 110.933 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -67.61 -42.7 81.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.423 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -79.77 132.89 59.79 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.639 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.8 -24.34 34.51 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.657 2.238 . . . . 0.0 112.141 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -64.21 -45.17 89.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.301 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.5 mt -68.38 -36.67 79.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.081 0.467 . . . . 0.0 110.439 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.609 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.0 mt-10 -55.89 -24.86 39.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.428 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.55 -49.87 74.93 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.78 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.928 HD22 ' CZ ' ' A' ' 142' ' ' PHE . 0.7 OUTLIER -71.42 -46.68 59.5 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.146 0.498 . . . . 0.0 111.782 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.718 ' CE3' HD22 ' A' ' 135' ' ' LEU . 19.3 t-105 -55.89 -46.06 78.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.506 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.609 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.3 m-70 -71.19 -34.07 70.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.539 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.577 ' O ' ' OG ' ' A' ' 127' ' ' SER . 10.3 tptt -55.54 -51.38 67.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.079 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -75.34 -47.15 29.05 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.974 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HB2' HD11 ' A' ' 135' ' ' LEU . 65.6 tttm -50.77 -39.55 52.69 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.747 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.3 m -94.1 -41.72 9.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.875 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.577 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 15.8 m -44.6 -27.11 0.44 Allowed 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.444 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -156.54 -97.08 0.13 Allowed Glycine 0 N--CA 1.462 0.373 0 C-N-CA 119.611 -1.281 . . . . 0.0 111.128 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.679 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.6 mttt -157.46 20.76 0.29 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.579 ' CE1' ' OE1' ' A' ' 134' ' ' GLU . 3.2 m-85 -60.12 50.05 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.671 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.679 ' N ' ' O ' ' A' ' 129' ' ' LYS . 0.1 OUTLIER -107.89 114.94 29.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.983 0.42 . . . . 0.0 111.705 -179.285 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.476 ' O ' ' HB3' ' A' ' 136' ' ' ASP . . . 120.51 -98.06 0.67 Allowed Glycine 0 CA--C 1.524 0.641 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.136 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.563 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 54.2 mp0 -78.79 -40.03 34.21 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.2 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.579 ' OE1' ' CE1' ' A' ' 130' ' ' PHE . 44.2 mt-10 -64.15 -43.55 94.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.563 0.697 . . . . 0.0 110.008 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.718 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -68.77 -35.62 77.29 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.275 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.517 ' CG ' ' N ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -62.36 -49.03 77.18 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.367 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 136' ' ' ASP . 18.6 ptpt -59.96 -38.52 82.73 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.478 ' N ' ' HG3' ' A' ' 137' ' ' LYS . 6.6 mt -59.84 -42.61 94.0 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.24 -39.19 78.64 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.583 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 81.9 mtp180 -54.45 -42.95 71.21 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.125 -1.03 . . . . 0.0 108.397 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -72.2 -39.4 68.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.728 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.928 ' CZ ' HD22 ' A' ' 120' ' ' LEU . 0.2 OUTLIER -59.76 -58.95 6.34 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.722 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 92.3 mt -62.1 -41.01 97.76 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.583 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 36.4 m170 -57.62 -41.4 81.25 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.534 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.593 ' CE1' HG23 ' A' ' 197' ' ' ILE . 10.5 m-70 -64.33 -39.7 94.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.627 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -59.55 -47.64 84.75 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.488 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -68.43 -53.48 23.31 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.631 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.56 -40.93 96.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.997 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 145' ' ' HIS . 41.3 t -62.59 -44.17 99.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.173 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.689 ' C ' ' CD2' ' A' ' 150' ' ' HIS . 0.8 OUTLIER -65.58 -38.96 91.02 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.576 -0.85 . . . . 0.0 109.312 -178.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.68 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 97.1 mt-10 -58.87 -45.94 88.98 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.125 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.499 ' N ' ' HD1' ' A' ' 152' ' ' TYR . 2.5 m-85 -62.55 -43.6 98.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.654 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.99 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.049 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 150' ' ' HIS . 12.8 t -60.24 -46.4 94.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 18.3 mt -63.17 -45.58 91.17 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 0.0 110.643 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.439 ' N ' ' CD2' ' A' ' 156' ' ' LEU . 2.0 mm? -64.53 -41.52 96.32 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.439 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -67.58 -27.25 66.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.843 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 62.0 m -69.13 -46.71 66.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.723 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.456 ' C ' HD12 ' A' ' 159' ' ' LEU . 4.1 pp -79.12 -20.97 47.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.68 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.454 ' N ' HD12 ' A' ' 159' ' ' LEU . 66.4 m -66.69 -41.33 88.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.153 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -59.92 -46.93 87.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.127 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.661 ' C ' ' H ' ' A' ' 164' ' ' GLU . 1.7 t -79.28 -174.06 3.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.322 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.533 ' N ' ' OG1' ' A' ' 162' ' ' THR . 92.4 mt-10 65.89 -28.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.977 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.661 ' H ' ' C ' ' A' ' 162' ' ' THR . 77.2 tt0 -99.81 40.36 1.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.189 0.519 . . . . 0.0 109.7 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 8.9 tp -135.05 136.99 51.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.289 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -124.06 48.74 1.86 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -110.4 37.2 2.8 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.253 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -144.38 -85.97 0.13 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.583 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 79.7 t -142.19 135.77 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.877 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.443 ' O ' HG23 ' A' ' 170' ' ' ILE . 14.1 tt -121.73 125.61 73.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.586 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.37 165.13 18.17 Favored Pre-proline 0 C--N 1.331 -0.197 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.328 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.1 131.98 41.39 Favored 'Trans proline' 0 C--N 1.307 -1.617 0 C-N-CA 122.535 2.157 . . . . 0.0 111.964 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.769 ' OG ' ' N ' ' A' ' 177' ' ' ASP . 25.1 p -143.42 -20.13 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.501 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 25.5 t0 64.06 -28.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.614 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.66 ' H ' ' C ' ' A' ' 173' ' ' SER . 14.8 mt -100.87 28.41 5.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.479 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.468 ' C ' ' CG ' ' A' ' 177' ' ' ASP . 0.1 OUTLIER 61.44 35.23 17.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.497 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.769 ' N ' ' OG ' ' A' ' 173' ' ' SER . 0.4 OUTLIER 44.61 89.52 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.453 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.577 HD12 ' O ' ' A' ' 180' ' ' GLY . 10.7 pt -129.5 153.47 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.528 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -64.32 -41.8 96.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.605 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.577 ' O ' HD12 ' A' ' 178' ' ' ILE . . . -108.13 139.91 15.28 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 13.8 t -62.06 -45.85 91.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.867 0.365 . . . . 0.0 110.701 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.659 ' C ' ' H ' ' A' ' 184' ' ' HIS . 10.7 t -74.05 -83.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.657 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 59.2 tp 59.39 -36.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.06 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.659 ' H ' ' C ' ' A' ' 182' ' ' VAL . 3.2 p80 -56.76 -44.72 82.05 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.658 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.612 ' N ' ' CG ' ' A' ' 184' ' ' HIS . 11.8 t -65.68 -43.36 89.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.927 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.681 ' O ' HD13 ' A' ' 190' ' ' LEU . 65.2 ttt180 -61.89 -47.48 84.8 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.636 -178.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . 0.588 ' C ' ' ND1' ' A' ' 187' ' ' HIS . 0.3 OUTLIER -71.39 -31.0 66.79 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.283 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 184' ' ' HIS . 57.5 m -62.55 -45.08 94.56 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.093 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.76 -39.15 93.58 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.389 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.681 HD13 ' O ' ' A' ' 186' ' ' ARG . 4.6 mp -62.34 -41.89 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.033 0.444 . . . . 0.0 110.51 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -68.78 -33.78 74.46 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.846 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.609 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 80.2 tt0 -67.8 -46.07 72.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.142 0.496 . . . . 0.0 111.685 -179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.413 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 pttt -72.03 -44.67 63.02 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.764 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -64.01 -41.3 97.51 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.558 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.609 ' HG3' ' O ' ' A' ' 192' ' ' GLU . 0.4 OUTLIER -66.04 -35.6 80.98 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.457 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 55.6 p -59.93 -39.68 86.33 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.593 HG23 ' CE1' ' A' ' 145' ' ' HIS . 70.2 mt -63.84 -43.59 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.26 178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -62.25 -41.05 98.09 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.48 0.657 . . . . 0.0 109.303 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.554 ' NE2' ' NE ' ' A' ' 195' ' ' ARG . 86.1 mt-30 -61.95 -39.26 91.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.091 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.74 -39.63 95.54 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.72 -42.59 99.73 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.75 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 0.5 OUTLIER -63.1 -37.17 86.13 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.099 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.579 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 1.9 tmm_? -63.26 -41.75 99.08 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.325 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.83 -40.55 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.157 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.86 -43.68 98.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.511 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.682 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.1 mtt180 -63.7 -37.01 85.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.186 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.536 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 45.2 t -63.6 -45.33 97.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.093 0.473 . . . . 0.0 110.134 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -67.0 -29.38 69.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.63 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -94.32 -45.41 7.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.531 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 206' ' ' ARG . 46.1 tt0 -98.83 -31.4 11.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.141 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.536 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . -77.48 14.0 10.17 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.484 ' CD1' ' C ' ' A' ' 212' ' ' TYR . 2.1 t80 -60.41 -47.0 87.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.059 0.456 . . . . 0.0 110.535 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 26.6 t -175.58 45.94 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.76 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' ' 210' ' ' GLN . 37.4 p -138.93 161.06 38.25 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.655 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -138.36 145.76 41.48 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.543 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -166.36 120.98 1.14 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.193 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -175.33 37.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.234 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.653 ' CE2' ' NH2' ' A' ' 222' ' ' ARG . 79.3 m-85 -87.29 93.4 9.38 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 120.394 -0.523 . . . . 0.0 110.05 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -157.39 -43.34 0.07 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.178 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.87 158.24 54.53 Favored Pre-proline 0 N--CA 1.464 0.24 0 C-N-CA 120.776 -0.369 . . . . 0.0 110.556 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -54.65 128.38 30.06 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.391 2.061 . . . . 0.0 112.087 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.665 ' HE ' HG23 ' A' ' 223' ' ' VAL . 62.7 ttp180 179.05 -95.88 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.519 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.665 HG23 ' HE ' ' A' ' 222' ' ' ARG . 5.0 t -61.53 -51.38 73.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-O 121.548 0.69 . . . . 0.0 110.585 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.421 HG13 ' CZ3' ' A' ' 227' ' ' TRP . 1.7 mt -66.05 -28.41 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.749 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -63.79 -40.7 97.29 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.464 ' HA ' HD12 ' A' ' 229' ' ' LEU . 13.7 mt -62.31 -40.94 97.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.026 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.547 ' CD1' ' N ' ' A' ' 227' ' ' TRP . 20.6 m0 -59.52 -38.6 81.39 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.095 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . 0.492 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 46.3 m-20 -63.5 -38.18 90.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.567 ' O ' ' N ' ' A' ' 232' ' ' SER . 89.1 mt -62.39 -41.55 98.74 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.129 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.481 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -32.75 -34.48 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.074 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.552 ' CG ' ' N ' ' A' ' 232' ' ' SER . 7.6 pt20 -66.26 -46.24 77.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.728 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.567 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.0 m -89.1 -6.75 56.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.362 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -72.99 9.54 1.15 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 232' ' ' SER . 58.8 t30 69.19 89.84 0.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.165 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.481 HD12 ' O ' ' A' ' 230' ' ' ALA . 79.6 mt -132.03 -173.25 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.687 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 62.1 p -84.38 164.77 18.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.6 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . 0.477 ' OD1' ' N ' ' A' ' 237' ' ' ASP . 21.7 p-10 -73.81 -46.2 46.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.61 -46.58 89.21 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.171 0.51 . . . . 0.0 110.469 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 243' ' ' PHE . 82.7 tt0 -61.22 -35.82 78.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.707 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 231' ' ' GLN . 2.8 mt -64.56 -39.76 94.33 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.428 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.69 -52.55 62.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.25 95.33 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.583 -0.447 . . . . 0.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.489 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.2 OUTLIER -70.02 -32.88 71.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.304 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -62.56 -55.75 24.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.125 0.488 . . . . 0.0 110.31 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -65.51 -37.46 86.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.541 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -56.76 -50.21 72.95 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.218 0.532 . . . . 0.0 110.377 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.514 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.0 mm? -63.96 -39.54 94.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.741 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -54.76 -47.27 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.146 0.498 . . . . 0.0 110.475 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -67.32 -39.39 85.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.614 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -59.69 -49.77 76.46 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.018 0.437 . . . . 0.0 111.364 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.0 pt-20 -63.72 -37.34 86.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.932 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.86 88.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -61.42 -51.47 68.62 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.093 0.473 . . . . 0.0 111.006 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -66.31 -35.35 74.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.201 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.72 -44.54 95.94 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.324 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.2 -43.96 97.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.02 -44.36 82.79 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.093 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -60.91 -40.49 93.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.45 -48.59 81.08 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 110.444 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -62.81 -35.66 80.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.619 HE21 ' CG2' ' A' ' 297' ' ' THR . 76.6 mm-40 -60.88 -44.48 97.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.183 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.98 -48.3 80.95 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.145 0.498 . . . . 0.0 109.8 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -64.16 -34.1 77.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.866 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 52.9 tp -62.25 -41.97 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.856 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.16 -45.5 84.68 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.554 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.2 mt -62.63 -43.4 98.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.118 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.36 88.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.209 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -60.92 -46.02 92.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.12 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.22 -45.99 91.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.136 0.493 . . . . 0.0 110.279 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.75 -40.14 94.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.447 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.722 ' O ' HD23 ' A' ' 271' ' ' LEU . 5.0 tt -59.17 -43.69 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.095 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -62.31 -41.08 98.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.269 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -66.81 -44.22 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.499 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.42 -36.92 85.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.627 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.03 -26.08 68.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 35.9 t -60.58 -39.83 89.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.376 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.42 -43.48 94.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.275 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.71 8.93 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -63.8 -42.88 97.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.732 0.301 . . . . 0.0 110.654 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 70.26 -3.85 9.96 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -96.98 -56.58 2.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 110.472 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -80.88 -15.95 54.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.746 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.51 -47.13 93.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.655 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 43.8 t -63.87 -43.99 94.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -59.73 -47.49 85.43 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.589 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . 0.45 ' OG ' HD12 ' A' ' 271' ' ' LEU . 15.2 t -63.03 -45.87 90.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -63.96 -38.82 92.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.669 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.97 -57.85 11.26 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.155 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.644 ' HD3' HD23 ' A' ' 292' ' ' LEU . 24.3 mmtt -64.32 -35.58 81.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.12 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -51.41 -52.95 41.6 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.268 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.25 -36.16 79.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.663 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.644 HD23 ' HD3' ' A' ' 289' ' ' LYS . 10.9 tp -60.74 -52.03 66.83 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.374 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 293' ' ' LEU . 14.8 tp -62.74 -42.85 99.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.451 0.643 . . . . 0.0 109.923 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.626 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.6 tt0 -64.7 -33.24 75.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.876 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -65.08 -47.58 80.29 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . 0.526 ' HG3' ' N ' ' A' ' 297' ' ' THR . 0.0 OUTLIER -62.36 -36.98 83.93 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.626 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 16.1 p -61.51 -44.11 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.43 -43.72 98.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.215 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.66 -37.7 88.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.122 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . 0.517 ' O ' HD13 ' A' ' 300' ' ' LEU . 0.2 OUTLIER -62.64 -44.46 96.23 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.1 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.31 99.57 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -60.22 -44.56 95.08 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.144 0.497 . . . . 0.0 110.365 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.0 m -61.04 -42.76 99.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.381 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.1 -43.16 88.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.031 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -59.91 -49.75 76.47 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.203 0.525 . . . . 0.0 110.464 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -63.3 -42.42 99.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.55 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.496 ' O ' ' HB2' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.35 -37.5 87.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.898 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.447 ' O ' ' CB ' ' A' ' 312' ' ' SER . 12.2 mt -61.52 -42.45 98.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.489 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -65.78 -60.75 2.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.96 0.41 . . . . 0.0 111.374 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -60.63 -48.34 82.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.392 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 307' ' ' HIS . 9.1 tp -61.72 -40.73 96.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.563 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 11.4 t -59.2 -44.69 92.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.346 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.35 -38.02 95.75 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -63.15 -45.05 93.7 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.984 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.6 mm -71.84 -25.52 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.88 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' A' ' 317' ' ' ARG . 28.0 p -44.03 -61.31 1.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.668 ' HE ' ' CD2' ' A' ' 323' ' ' LEU . 7.3 ptt-85 -67.06 -38.86 86.56 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 317' ' ' ARG . . . 84.46 -34.7 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.42 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -149.63 140.14 22.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.954 0.883 . . . . 0.0 112.373 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -176.5 82.26 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 113.954 -1.476 . . . . 0.0 107.24 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 58.11 53.23 6.84 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.644 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 58.18 33.03 22.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.499 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.668 ' CD2' ' HE ' ' A' ' 317' ' ' ARG . 93.7 mt . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.582 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 86.3 t80 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 t -137.21 149.35 47.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.643 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 88.9 mmt-85 -113.7 100.82 8.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.529 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -143.46 112.23 6.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.517 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -78.44 -75.08 0.24 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.758 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 48.49 80.85 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.479 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.65 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -90.94 162.76 32.03 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.537 -179.738 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -64.73 149.17 90.12 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.568 2.179 . . . . 0.0 112.073 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 31.8 pttt -151.55 54.46 1.36 Allowed Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.078 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 9' ' ' LYS . 34.3 Cg_endo -67.15 153.91 76.02 Favored 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 122.641 2.227 . . . . 0.0 111.856 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.494 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -176.69 -56.24 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.846 -179.707 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 11' ' ' SER . 59.7 Cg_endo -69.65 150.89 69.45 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 122.393 2.062 . . . . 0.0 111.943 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -123.74 145.81 48.74 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.544 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.5 mtp180 -78.86 151.4 31.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.336 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -114.02 168.52 9.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.505 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -71.53 160.96 31.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.782 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -153.62 -38.73 0.02 OUTLIER Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -75.41 151.58 38.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.741 0.305 . . . . 0.0 110.568 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.9 -38.15 85.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.87 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -129.19 149.67 50.9 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.569 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -87.64 -12.2 46.22 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.512 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 78.5 mtp -119.42 138.5 53.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.109 0.48 . . . . 0.0 111.04 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -64.44 -36.53 84.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.44 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.94 -48.31 82.23 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.545 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.449 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.0 mp -61.73 -38.36 87.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.477 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.431 ' OD1' ' O ' ' A' ' 26' ' ' ASN . 55.5 t-20 -63.18 -39.24 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.094 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.8 tp60 -60.25 -46.55 89.41 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.348 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.72 -42.47 98.99 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.352 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -61.59 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.176 0.512 . . . . 0.0 110.533 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -58.46 -44.03 89.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.128 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.21 -41.59 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.367 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.0 88.48 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.075 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -62.06 -39.61 92.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.853 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -61.7 -41.49 97.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.347 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.16 -39.63 95.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.91 107.96 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.821 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -125.08 154.6 71.52 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.678 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.412 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 82.8 Cg_exo -42.93 154.88 0.13 Allowed 'Trans proline' 0 N--CA 1.492 1.382 0 C-N-CA 122.507 2.138 . . . . 0.0 112.372 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 32.2 Cg_exo -56.01 -43.81 53.16 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.585 2.19 . . . . 0.0 112.209 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.472 ' H ' HG22 ' A' ' 40' ' ' VAL . 2.8 m -67.36 -46.06 84.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.996 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.6 mmt85 -65.37 -42.1 93.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.805 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 tp -63.92 -43.99 94.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.593 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.79 -42.76 90.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.675 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -66.96 -46.24 75.27 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.3 tp -62.94 -45.7 91.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.359 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -59.5 -41.96 91.09 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.983 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.51 -47.36 85.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.657 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -57.0 -47.21 81.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.365 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.4 mt -57.06 -41.99 79.73 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.224 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.63 -38.79 85.96 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.228 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 47' ' ' ALA . 4.9 mm -61.34 -43.32 96.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.557 ' NE2' HD22 ' A' ' 80' ' ' ASN . 49.1 mm-40 -58.16 -47.66 82.68 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.622 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.26 -47.4 81.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.154 0.502 . . . . 0.0 110.237 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.47 HH11 ' HD3' ' A' ' 54' ' ' ARG . 39.3 mtp-105 -62.0 -41.97 98.63 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.611 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -63.59 -36.81 85.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.413 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -60.66 -49.19 78.53 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.012 0.434 . . . . 0.0 109.999 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.83 -41.18 97.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.259 -0.577 . . . . 0.0 110.089 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.56 96.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.7 t90 -59.7 -42.59 93.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.729 0.299 . . . . 0.0 110.45 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -60.49 -45.61 93.12 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.771 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -60.72 -41.81 96.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.839 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.4 mt -61.05 -41.23 96.21 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.8 -38.91 86.97 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.684 ' O ' HD23 ' A' ' 64' ' ' LEU . 4.3 tt -60.34 -45.6 92.88 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -66.43 -34.65 78.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.32 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.83 30.03 8.25 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.6 mt -86.33 -49.6 7.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.732 0.301 . . . . 0.0 110.872 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.515 ' OD1' ' O ' ' A' ' 68' ' ' ASP . 49.2 p-10 -62.99 123.4 18.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.637 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -139.24 -35.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.436 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 71' ' ' GLY . 43.7 p-10 -66.21 -37.3 85.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.72 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.546 ' N ' ' OD1' ' A' ' 70' ' ' ASP . . . 88.04 0.51 83.11 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.44 -37.75 87.11 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.451 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.416 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 87.4 mttt -54.4 -53.91 47.75 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.003 0.43 . . . . 0.0 110.122 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -60.92 -39.13 88.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.93 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.59 -39.88 95.13 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.475 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.416 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 81.6 mtm180 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.527 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 83.8 mt -63.09 -44.97 94.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.211 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.7 -46.34 89.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-O 121.152 0.501 . . . . 0.0 110.375 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.581 ' O ' HG23 ' A' ' 83' ' ' VAL . 18.6 tpt180 -60.09 -43.8 95.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.977 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.557 HD22 ' NE2' ' A' ' 52' ' ' GLN . 34.5 t30 -61.73 -40.09 93.86 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.448 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.606 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.73 -48.73 80.5 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.717 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -65.17 -38.17 89.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.507 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 79' ' ' ARG . 55.2 t -62.93 -46.89 95.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.493 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.19 -51.07 77.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.467 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.72 -41.07 96.24 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.888 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.96 92.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.523 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -62.63 -47.76 82.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.992 0.425 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -72.78 -22.18 60.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.126 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.45 25.13 73.48 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 90' ' ' LEU . 38.7 mt -87.15 -2.48 58.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.886 0.374 . . . . 0.0 110.537 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -61.85 -45.12 95.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.707 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.51 158.01 20.11 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -146.6 154.2 41.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.834 0.349 . . . . 0.0 110.898 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -135.08 -165.49 1.68 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.68 179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.426 ' O ' ' N ' ' A' ' 97' ' ' ARG . 99.7 m-20 57.33 -85.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.717 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 94' ' ' LYS . . . 56.98 -85.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.952 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.426 ' N ' ' O ' ' A' ' 95' ' ' ASP . 21.7 mmm180 -93.87 -74.03 0.55 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.363 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 54.02 80.38 0.12 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.347 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.445 ' O ' HG13 ' A' ' 99' ' ' VAL . 14.5 p -127.09 131.18 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.749 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 81.2 p -138.72 154.13 48.55 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.675 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.2 t -179.14 120.0 0.07 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.509 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.599 ' CG ' ' H ' ' A' ' 103' ' ' SER . 12.8 p-10 -177.19 -85.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.947 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.599 ' H ' ' CG ' ' A' ' 102' ' ' ASN . 1.5 m 51.43 109.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.552 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.4 mp -96.24 -0.51 49.71 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.787 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 1.9 m 58.17 32.91 22.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.829 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -98.59 92.56 1.23 Allowed Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.957 -0.857 . . . . 0.0 110.957 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 11.6 t -149.1 163.46 37.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.712 0.291 . . . . 0.0 110.431 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -133.44 155.04 50.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.671 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 48.7 tp10 -153.23 136.04 15.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.499 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -151.82 116.59 5.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.767 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 172.39 -101.57 0.17 Allowed Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.489 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 73.8 mt -119.36 132.77 55.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.856 0.36 . . . . 0.0 110.647 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.468 ' O ' ' OD1' ' A' ' 113' ' ' ASP . 48.7 t0 -89.68 -26.59 20.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.452 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -82.69 114.9 55.25 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.691 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -54.44 -33.95 79.48 Favored 'Trans proline' 0 N--CA 1.498 1.775 0 C-N-CA 122.482 2.121 . . . . 0.0 112.517 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -60.51 -45.36 94.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.954 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.1 mt -68.83 -37.26 79.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.087 0.47 . . . . 0.0 110.375 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.597 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.6 mt-10 -57.97 -25.96 61.69 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.599 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 70.1 mmtt -61.53 -54.75 39.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.703 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.61 -43.98 79.15 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.572 ' CE3' HD22 ' A' ' 135' ' ' LEU . 13.4 t-105 -58.84 -48.91 79.68 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.478 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.597 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.7 m-70 -70.04 -33.38 71.9 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.733 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.534 ' O ' ' OG ' ' A' ' 127' ' ' SER . 11.6 tptt -56.86 -51.27 69.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.718 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.91 -47.28 59.97 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 119.596 -0.841 . . . . 0.0 111.086 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -53.71 -51.48 63.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.918 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.2 m -75.25 -43.27 52.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.73 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 9.6 m -44.48 -30.9 0.95 Allowed 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -178.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -160.54 -96.55 0.11 Allowed Glycine 0 CA--C 1.517 0.166 0 C-N-CA 119.48 -1.343 . . . . 0.0 111.526 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.693 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.6 mttt -153.63 21.43 0.53 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -59.14 50.56 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.511 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.693 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.8 p -109.17 135.4 50.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.348 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 96.43 -96.62 1.93 Allowed Glycine 0 CA--C 1.526 0.728 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.908 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.546 ' OE1' ' N ' ' A' ' 133' ' ' GLU . 56.6 mp0 -72.71 -43.79 62.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.342 . . . . 0.0 111.166 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.514 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 46.9 mp0 -63.97 -51.77 62.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.023 0.439 . . . . 0.0 110.404 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.572 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.8 mt -61.56 -39.69 92.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.673 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -60.32 -42.81 96.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.975 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -62.04 -41.4 98.07 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 110.094 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.51 HD13 ' O ' ' A' ' 134' ' ' GLU . 9.4 mp -59.81 -41.81 92.07 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.415 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -66.54 -35.44 80.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 176.687 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.421 ' O ' ' CD2' ' A' ' 144' ' ' HIS . 69.9 mtp180 -55.31 -43.27 74.7 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.233 178.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.736 ' OE1' HD21 ' A' ' 204' ' ' LEU . 96.5 mt-10 -71.18 -41.19 70.65 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.824 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.415 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 3.6 m-85 -60.46 -54.93 39.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.793 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.02 -39.59 90.33 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.937 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.421 ' CD2' ' O ' ' A' ' 140' ' ' ARG . 4.1 m170 -56.16 -42.68 77.41 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.578 ' CE1' HG23 ' A' ' 197' ' ' ILE . 5.7 m-70 -63.05 -40.78 98.73 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.425 178.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -61.49 -42.93 99.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.884 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.704 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 98.7 mt-10 -67.97 -46.25 71.9 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 111.555 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -70.83 -43.93 67.55 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.55 -50.62 77.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.725 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -70.08 -23.87 63.14 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.59 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.686 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 19.8 mm-40 -68.18 -45.0 74.64 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.404 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 16.8 m-85 -62.78 -45.35 93.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -65.5 -41.03 93.66 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.583 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 150' ' ' HIS . 35.2 t -61.94 -46.33 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.0 0.429 . . . . 0.0 110.286 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 81.2 mt -63.44 -43.1 98.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.513 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.582 HD21 HD21 ' A' ' 190' ' ' LEU . 35.0 mt -63.19 -44.29 95.78 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.773 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -67.06 -29.88 69.79 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.972 0.415 . . . . 0.0 110.411 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 58.7 m -71.79 -47.22 54.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.297 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.694 HD12 ' N ' ' A' ' 160' ' ' SER . 4.4 pp -79.11 -29.48 43.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.813 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.694 ' N ' HD12 ' A' ' 159' ' ' LEU . 85.6 p -62.19 -41.79 98.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.619 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -74.03 -49.12 25.68 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.696 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.63 ' C ' ' H ' ' A' ' 164' ' ' GLU . 0.2 OUTLIER -97.78 176.14 5.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.398 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.447 ' H ' HG22 ' A' ' 162' ' ' THR . 50.1 mt-10 53.66 1.31 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.085 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.63 ' H ' ' C ' ' A' ' 162' ' ' THR . 68.9 tt0 -131.51 44.84 2.88 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.404 ' O ' HG23 ' A' ' 165' ' ' ILE . 16.5 tt -134.68 133.26 54.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.843 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -172.12 40.24 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.477 ' HG2' ' N ' ' A' ' 168' ' ' ASN . 78.0 tt0 60.43 163.1 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.493 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.477 ' N ' ' HG2' ' A' ' 167' ' ' GLU . 58.6 t30 -69.69 108.24 3.8 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.924 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 169' ' ' VAL . 5.4 p -155.03 124.26 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.355 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 17.3 tt -135.3 147.47 29.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.609 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.21 165.58 12.45 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 120.779 0.323 . . . . 0.0 110.415 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.83 -30.91 49.4 Favored 'Trans proline' 0 C--N 1.308 -1.603 0 C-N-CA 122.645 2.23 . . . . 0.0 112.005 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 11.4 m -51.56 114.81 1.36 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.841 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -64.73 -38.16 90.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.168 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -137.8 42.89 2.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.243 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.53 ' O ' ' OG ' ' A' ' 176' ' ' SER . 0.3 OUTLIER 54.04 19.22 1.97 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.307 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 45.27 65.71 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.208 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.685 HG22 ' H ' ' A' ' 180' ' ' GLY . 25.0 mt -106.2 127.95 61.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.373 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -86.26 -8.74 57.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.48 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.685 ' H ' HG22 ' A' ' 178' ' ' ILE . . . 133.03 48.8 0.1 OUTLIER Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.509 ' H ' ' CG2' ' A' ' 178' ' ' ILE . 61.7 m -63.48 -85.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.622 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 6.3 t -147.35 -8.94 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.875 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 57.7 tp -62.48 -44.22 96.91 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.225 0.536 . . . . 0.0 110.735 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.472 ' CD2' ' H ' ' A' ' 185' ' ' SER . 2.2 p80 -56.92 -42.01 79.19 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.538 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.472 ' H ' ' CD2' ' A' ' 184' ' ' HIS . 71.6 m -60.33 -42.71 96.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.196 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -61.37 -41.65 97.43 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.545 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . 0.4 ' HA ' HD12 ' A' ' 190' ' ' LEU . 50.5 m-70 -64.9 -41.01 95.96 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.391 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 60.7 m -61.26 -44.45 97.23 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.307 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.76 -38.58 88.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.29 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.582 HD21 HD21 ' A' ' 156' ' ' LEU . 11.4 mt -60.93 -46.86 88.98 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.539 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.555 ' HB3' HH21 ' A' ' 195' ' ' ARG . 56.5 mtpt -74.36 -32.52 62.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 11.2 tm-20 -68.08 -44.81 75.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.364 . . . . 0.0 111.296 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.502 ' NZ ' HD23 ' A' ' 190' ' ' LEU . 17.4 pttt -73.47 -43.91 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.173 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.724 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.83 -40.83 88.12 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.854 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.555 HH21 ' HB3' ' A' ' 191' ' ' LYS . 17.9 ptp180 -67.36 -38.19 84.39 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.447 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.3 p -60.31 -41.15 92.88 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.578 HG23 ' CE1' ' A' ' 145' ' ' HIS . 92.1 mt -64.3 -44.63 97.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.452 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.75 -40.85 98.53 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.961 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.403 ' HA ' ' OD2' ' A' ' 202' ' ' ASP . 89.4 mm-40 -60.4 -41.3 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.688 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.92 -40.15 98.48 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 201' ' ' LEU . 36.2 mt -62.04 -42.86 99.63 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.109 179.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.538 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.4 OUTLIER -64.14 -35.27 80.23 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.474 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.3 tmt_? -60.98 -43.77 98.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.739 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.736 HD21 ' OE1' ' A' ' 141' ' ' GLU . 31.6 mt -62.26 -40.25 95.58 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -64.99 -45.08 87.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.991 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' A' ' 210' ' ' GLN . 82.7 mtp180 -65.21 -44.43 88.36 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.146 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.459 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -68.31 -40.87 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.131 0.491 . . . . 0.0 110.345 -179.459 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.444 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 68.4 m -60.28 -37.91 81.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.473 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -95.42 -46.66 6.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.636 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 206' ' ' ARG . 54.9 tt0 -81.3 -35.65 30.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.109 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -90.79 58.95 3.28 Favored Glycine 0 CA--C 1.519 0.297 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.607 ' CD2' ' O ' ' A' ' 213' ' ' SER . 67.2 t80 -120.08 164.51 16.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.922 0.391 . . . . 0.0 110.532 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.607 ' O ' ' CD2' ' A' ' 212' ' ' TYR . 26.9 p -77.26 163.53 26.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.968 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 1.4 t -150.43 156.37 41.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.786 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -149.77 -178.0 6.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.282 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -142.08 -175.01 4.26 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.101 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.544 ' O ' ' HB3' ' A' ' 218' ' ' PHE . 26.1 tp10 -138.56 6.67 2.52 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.357 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.671 ' CG ' ' N ' ' A' ' 219' ' ' GLU . 68.3 t80 82.32 178.72 0.07 Allowed 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.84 ' O ' HG11 ' A' ' 223' ' ' VAL . 2.7 tm-20 74.55 52.31 0.09 Allowed 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 -176.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.507 ' O ' ' CG1' ' A' ' 223' ' ' VAL . 4.2 mp0 61.56 148.19 0.09 OUTLIER Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.226 -177.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.475 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 74.3 Cg_endo -79.3 169.99 18.11 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.396 2.064 . . . . 0.0 111.759 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 89.6 mtm180 69.59 -46.77 0.59 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.517 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 1.018 HG13 ' H ' ' A' ' 224' ' ' ILE . 3.4 p -57.64 -97.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.798 0 CA-C-O 121.458 0.647 . . . . 0.0 111.831 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 1.018 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.3 OUTLIER -42.92 -29.07 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.333 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 223' ' ' VAL . 98.5 m-20 -62.51 -44.84 95.37 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 223' ' ' VAL . 1.5 mp -59.99 -40.18 88.28 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.557 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 33.3 m0 -59.68 -43.0 94.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.783 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -67.75 -27.26 66.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 2.0 mt -63.08 -46.27 88.18 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.411 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.537 ' O ' ' C ' ' A' ' 231' ' ' GLN . . . -35.54 -67.25 0.16 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.814 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.537 ' C ' ' O ' ' A' ' 230' ' ' ALA . 12.8 tt0 24.62 -103.73 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.937 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.0 p -113.47 27.84 9.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.331 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.86 81.85 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.327 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -175.34 72.42 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.682 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.573 HD22 ' HD3' ' A' ' 319' ' ' ARG . 96.3 mt -134.61 -169.25 2.3 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.741 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.414 ' OG1' ' OE1' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -110.46 -152.56 0.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.764 -178.902 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -92.53 -59.54 2.05 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.117 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.08 -42.8 99.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.414 ' OE1' ' OG1' ' A' ' 236' ' ' THR . 89.2 mt-10 -60.18 -34.0 72.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.602 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.681 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -62.75 -44.4 96.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.292 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -64.89 -47.73 76.74 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.665 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.25 99.2 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.785 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.511 ' O ' ' HG2' ' A' ' 246' ' ' GLU . 1.3 t80 -61.82 -47.58 84.47 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.007 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.25 -42.53 98.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.572 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -59.09 -57.88 11.1 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.396 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 243' ' ' PHE . 13.3 pt-20 -58.99 -38.87 80.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.948 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 1.9 mm? -61.55 -41.98 98.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.381 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.408 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 65.9 tttm -61.09 -42.23 98.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.157 0.503 . . . . 0.0 109.858 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -65.91 -39.5 90.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.801 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -61.84 -48.49 80.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.562 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 13.7 pt-20 -62.01 -41.87 98.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.079 0.466 . . . . 0.0 110.114 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -62.83 -38.2 89.82 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.152 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -61.96 -62.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.247 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.13 -37.21 13.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.03 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -65.35 -46.35 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.688 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -62.98 -43.31 99.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -58.07 -43.87 87.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.863 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.11 -40.65 94.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.252 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . 0.422 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 83.1 t60 -59.18 -47.61 84.67 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.297 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -62.7 -37.43 86.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.363 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -57.77 -47.66 81.88 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 120.993 0.425 . . . . 0.0 110.4 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -61.76 -43.24 99.25 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.042 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . 0.422 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 4.6 mp0 -60.46 -39.02 86.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.902 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . 0.403 HD21 ' HB3' ' A' ' 293' ' ' LEU . 38.0 mt -61.98 -41.84 98.48 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.338 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.92 -48.02 83.75 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-O 121.118 0.485 . . . . 0.0 110.44 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.3 mt -63.03 -43.49 99.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.157 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.12 85.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.27 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.53 -47.73 84.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.222 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -63.31 -45.0 93.37 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.992 0.425 . . . . 0.0 110.676 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -61.33 -42.88 99.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.469 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.668 ' O ' HD23 ' A' ' 271' ' ' LEU . 1.8 tt -60.8 -42.66 98.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.907 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -59.69 -44.07 93.78 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.257 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -71.59 -34.05 69.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.88 0.371 . . . . 0.0 110.509 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.581 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.84 -37.24 86.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.07 -25.36 66.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.871 0.367 . . . . 0.0 110.537 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 67.4 m -87.95 2.72 50.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.874 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.583 HG13 ' N ' ' A' ' 278' ' ' GLY . 11.0 p -60.47 -44.47 96.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.652 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.583 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 156.9 -99.26 0.18 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -61.97 -40.93 97.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 0.0 110.258 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.5 32.81 40.9 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -66.68 -36.8 83.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.836 0.351 . . . . 0.0 110.738 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -77.49 -6.75 54.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.99 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.99 -44.99 99.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.8 t -60.5 -45.32 94.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.149 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.96 -45.84 93.14 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.992 0.425 . . . . 0.0 110.756 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 50.5 m -60.63 -41.9 95.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.182 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -62.23 -40.6 96.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.587 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.02 -57.02 14.93 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.671 ' HD3' HD23 ' A' ' 292' ' ' LEU . 15.0 mmtm -64.62 -35.93 82.6 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.304 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -52.68 -46.99 67.47 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.47 -37.66 80.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.47 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.671 HD23 ' HD3' ' A' ' 289' ' ' LYS . 19.6 tp -61.25 -51.12 70.25 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.712 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . 0.403 ' HB3' HD21 ' A' ' 264' ' ' LEU . 10.2 mp -63.56 -41.29 98.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.044 0.45 . . . . 0.0 109.979 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -65.34 -35.04 79.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.077 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.5 -50.07 67.92 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -62.17 -42.74 99.55 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.611 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.4 m -61.28 -48.71 80.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.472 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.33 -41.93 98.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.171 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -62.28 -40.23 95.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.1 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -43.63 98.32 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.128 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.93 -42.68 98.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.72 -44.61 96.58 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.043 0.449 . . . . 0.0 110.513 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.4 m -60.28 -44.44 95.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.449 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.09 -42.54 90.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.926 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.56 -51.38 70.15 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 110.809 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.67 -43.41 96.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.24 -36.41 83.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.993 0.425 . . . . 0.0 109.981 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.557 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 12.2 mt -60.35 -44.55 95.45 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.138 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . 0.403 ' O ' ' OG ' ' A' ' 312' ' ' SER . 96.5 mm-40 -70.91 -57.3 4.72 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.543 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.86 -49.9 75.62 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.676 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 12.9 tp -62.59 -41.63 99.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.508 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 37.5 p -59.47 -40.59 87.43 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.439 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.93 -41.06 95.6 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.553 ' HE ' ' HG ' ' A' ' 323' ' ' LEU . 79.0 mtp180 -61.74 -44.62 96.55 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.724 -0.28 . . . . 0.0 110.86 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.569 ' C ' ' H ' ' A' ' 318' ' ' ALA . 2.7 mm -65.01 -41.99 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.0 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.6 t -47.65 -42.67 24.99 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -97.2 5.58 49.87 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.569 ' H ' ' C ' ' A' ' 315' ' ' ILE . . . 56.63 -89.98 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.744 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.625 ' CB ' HD13 ' A' ' 323' ' ' LEU . 4.2 ptm180 168.57 113.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.333 -178.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -65.8 -44.03 86.9 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.49 ' O ' ' O ' ' A' ' 322' ' ' GLU . 0.1 OUTLIER -147.47 80.26 1.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.664 179.165 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.49 ' O ' ' O ' ' A' ' 321' ' ' ASN . 80.7 tt0 43.42 102.63 0.0 OUTLIER 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.993 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.625 HD13 ' CB ' ' A' ' 319' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.548 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.423 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 64.9 t80 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.7 m -62.38 -40.98 98.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.732 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.9 ttt85 -133.56 141.7 47.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.506 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -126.33 138.55 53.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.735 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -152.24 133.21 14.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.451 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -105.9 144.56 32.45 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.664 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.658 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -117.08 -50.47 0.04 OUTLIER Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.163 -179.777 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.658 ' HD2' ' H ' ' A' ' 7' ' ' GLN . 94.4 Cg_endo -82.79 160.31 16.26 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.577 2.184 . . . . 0.0 112.223 -179.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.68 157.82 48.93 Favored Pre-proline 0 N--CA 1.464 0.255 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.197 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.98 155.96 56.76 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.637 2.225 . . . . 0.0 112.086 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.632 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -103.56 -39.07 0.2 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.739 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.632 ' CD ' ' N ' ' A' ' 11' ' ' SER . 31.6 Cg_exo -59.75 146.02 96.64 Favored 'Trans proline' 0 N--CA 1.494 1.549 0 C-N-CA 122.571 2.181 . . . . 0.0 111.813 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -68.11 107.48 2.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.516 -179.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.428 ' O ' ' HG2' ' A' ' 14' ' ' ARG . 67.1 ttt-85 -112.31 26.73 10.29 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.143 0.497 . . . . 0.0 110.341 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.459 ' HG2' ' N ' ' A' ' 16' ' ' SER . 84.9 tt0 50.08 -108.18 0.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.587 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.459 ' N ' ' HG2' ' A' ' 15' ' ' GLU . 16.4 t 41.82 -139.53 0.14 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.943 0.402 . . . . 0.0 110.644 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.79 151.25 26.7 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.706 -0.957 . . . . 0.0 110.706 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -131.03 132.65 45.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.896 0.379 . . . . 0.0 110.668 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' A' ' 19' ' ' GLU . 57.5 mp0 -140.18 -1.38 1.55 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.432 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -140.62 161.12 38.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.912 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -62.85 -34.8 78.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.06 147.51 46.01 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.744 0.783 . . . . 0.0 111.222 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -63.57 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.557 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -55.57 -48.61 74.51 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.388 0.613 . . . . 0.0 109.954 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.74 -38.78 91.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.327 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -62.63 -39.03 92.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.573 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.78 -47.28 87.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.511 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.425 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.8 mm? -60.64 -41.85 95.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.048 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.491 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 49.5 t-105 -60.03 -45.23 93.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.282 0.563 . . . . 0.0 110.435 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -56.9 -43.76 81.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.153 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -60.62 -41.72 95.39 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.338 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.95 86.78 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.076 0.465 . . . . 0.0 110.046 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.491 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 76.5 mt-30 -62.6 -37.86 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -60.6 -43.9 96.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.401 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.12 -38.89 92.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.57 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.87 105.66 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.756 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -127.53 154.39 77.51 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.631 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -38.57 155.35 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.791 2.327 . . . . 0.0 112.144 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.37 -43.25 18.67 Favored 'Trans proline' 0 C--N 1.307 -1.639 0 C-N-CA 122.675 2.25 . . . . 0.0 112.403 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 76.9 t -63.66 -47.16 92.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.472 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -64.08 -41.75 97.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.3 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.68 ' C ' HD23 ' A' ' 42' ' ' LEU . 8.5 tt -61.93 -43.47 98.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.773 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.33 -41.54 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.234 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.51 -44.66 74.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.1 tp -62.73 -49.2 75.98 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.961 0.41 . . . . 0.0 110.462 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -59.81 -42.06 92.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.336 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.47 -38.93 93.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.606 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -60.34 -52.42 65.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.096 0.474 . . . . 0.0 110.455 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.01 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.253 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.09 -45.73 83.14 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.286 0.565 . . . . 0.0 110.187 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.38 -42.78 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.661 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 tp60 -52.97 -41.83 64.95 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -63.43 -40.74 97.98 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -61.51 -43.58 98.61 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.467 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -60.54 -42.23 96.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.539 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.56 -47.59 79.14 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.323 0.583 . . . . 0.0 109.889 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.54 -39.74 88.99 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.34 0.59 . . . . 0.0 109.811 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.72 87.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.612 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 68.7 t90 -57.21 -39.92 76.42 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -58.42 -46.69 85.98 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.24 -43.52 96.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.308 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -62.19 -40.41 95.97 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.015 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -58.5 -43.62 89.14 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.1 mt -60.96 -40.47 93.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.775 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 57.3 t0 -64.84 -35.49 81.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.26 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.1 33.33 7.35 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.181 -0.767 . . . . 0.0 111.181 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.2 mt -91.86 -40.37 11.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.913 0.387 . . . . 0.0 110.738 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -88.11 117.0 26.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.549 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -125.74 -37.82 2.28 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.515 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -67.09 -34.0 76.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.735 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.27 12.61 62.99 Favored Glycine 0 CA--C 1.528 0.849 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.55 -37.62 88.03 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.439 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -60.42 -47.11 87.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.067 0.461 . . . . 0.0 110.251 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -59.81 -43.5 94.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.363 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.69 -37.95 86.01 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.522 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.05 -41.69 99.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.89 -43.73 95.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.29 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.22 -44.5 97.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.076 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.616 ' O ' HG23 ' A' ' 83' ' ' VAL . 44.9 ttm180 -59.09 -42.45 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.063 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -62.72 -40.46 97.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.556 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.671 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.41 -48.45 80.61 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.89 -179.574 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -64.9 -38.88 92.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.659 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 79' ' ' ARG . 61.4 t -62.52 -46.4 96.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 94.1 mt -60.49 -48.2 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.066 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' A' ' 85' ' ' LEU . 22.7 mt -65.01 -40.86 95.54 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.068 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.37 -47.35 85.76 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.805 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.14 -47.58 82.14 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.116 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -66.15 -27.22 67.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.448 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 68.27 24.98 74.83 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 90' ' ' LEU . 97.2 mt -103.45 16.06 27.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.831 0.348 . . . . 0.0 110.827 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.559 ' OD1' ' N ' ' A' ' 92' ' ' GLY . 41.6 p-10 -60.95 -40.93 95.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.606 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.559 ' N ' ' OD1' ' A' ' 91' ' ' ASP . . . 114.88 51.95 0.44 Allowed Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 53.8 tttm -144.99 92.55 2.28 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.778 0.323 . . . . 0.0 110.295 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -92.96 -23.82 18.59 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.651 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 58.84 49.54 9.74 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.815 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.675 ' O ' ' N ' ' A' ' 98' ' ' GLN . . . 64.99 -85.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.46 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 44.17 -80.66 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.606 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.675 ' N ' ' O ' ' A' ' 96' ' ' ALA . 17.2 tt0 54.25 82.04 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.798 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 5.3 m -127.78 129.9 70.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.272 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 54.1 m -111.57 114.07 26.9 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.64 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.7 t -63.59 -45.59 89.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.731 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -97.27 76.71 2.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.397 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.2 p -72.66 151.62 42.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.714 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 37.3 tp -122.27 128.58 51.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.082 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 42.3 t -131.16 150.16 52.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.498 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -130.69 38.19 1.99 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.427 ' H ' HG22 ' A' ' 107' ' ' THR . 0.0 OUTLIER -62.43 -44.12 97.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.792 0.329 . . . . 0.0 110.331 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.413 ' O ' ' O ' ' A' ' 107' ' ' THR . 99.0 mm-40 49.95 99.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.721 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -138.51 -22.94 0.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.553 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -62.84 -42.34 99.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.624 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.508 ' C ' HD22 ' A' ' 112' ' ' LEU . . . 110.87 -55.09 0.52 Allowed Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.933 HD22 ' N ' ' A' ' 112' ' ' LEU . 0.9 OUTLIER -107.85 129.16 55.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.978 0.418 . . . . 0.0 110.447 -179.471 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -85.72 -65.03 1.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.862 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -93.71 152.35 40.68 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.47 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.47 -18.69 43.56 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.707 2.271 . . . . 0.0 111.909 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -63.82 -43.7 95.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.844 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.581 ' N ' HD12 ' A' ' 117' ' ' LEU . 7.2 mp -74.33 -28.07 60.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.612 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.617 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.5 mt-10 -60.45 -32.65 71.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.642 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.4 mtmt -62.09 -45.91 91.43 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.905 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 47.6 mt -69.02 -46.59 67.58 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.552 ' CE3' HD22 ' A' ' 135' ' ' LEU . 8.4 t-105 -62.95 -44.47 95.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.542 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.617 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -69.47 -38.94 77.95 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.164 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.521 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.0 mptt -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.173 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.464 ' HB1' ' HB2' ' A' ' 130' ' ' PHE . . . -70.26 -45.57 66.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.791 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.482 ' HB2' HD11 ' A' ' 135' ' ' LEU . 65.3 tttm -48.25 -46.08 35.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.136 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 18.2 m -109.65 -60.2 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.643 -0.423 . . . . 0.0 112.005 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.64 -11.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.748 -178.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.432 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -134.13 -3.74 3.09 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 56.91 12.75 1.27 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.265 0.555 . . . . 0.0 109.756 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.464 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 6.0 m-30 -68.86 50.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.669 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 5.6 p -96.15 118.15 32.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.731 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 119.93 -97.97 0.69 Allowed Glycine 0 CA--C 1.53 0.979 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.492 178.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -78.85 -43.57 24.81 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.268 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.487 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.0 mp0 -60.67 -47.39 86.48 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.555 -0.458 . . . . 0.0 109.851 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.552 HD22 ' CE3' ' A' ' 121' ' ' TRP . 2.0 mt -62.87 -41.62 99.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.018 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.39 -40.57 94.83 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.499 -0.48 . . . . 0.0 109.999 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.6 -42.27 99.47 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.077 0.465 . . . . 0.0 110.173 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.59 -43.97 93.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.444 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.3 OUTLIER -67.06 -37.7 84.48 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 144' ' ' HIS . 52.6 mtp180 -53.32 -43.93 68.01 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.721 ' OE1' HD21 ' A' ' 204' ' ' LEU . 97.8 mt-10 -71.5 -40.85 69.92 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.669 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.444 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.9 m-85 -59.01 -57.91 10.99 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.568 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 44.3 mt -60.72 -39.06 87.22 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.299 -0.561 . . . . 0.0 110.254 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.44 ' CD2' ' O ' ' A' ' 140' ' ' ARG . 4.0 m170 -51.32 -48.05 62.49 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -63.27 -39.86 95.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.664 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt -61.04 -41.56 96.81 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.318 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -67.68 -53.11 30.36 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 120.77 0.319 . . . . 0.0 111.577 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -61.3 -44.04 97.87 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.808 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.4 t -62.08 -43.86 98.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.747 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.682 ' O ' ' OD1' ' A' ' 153' ' ' ASN . 2.3 m170 -60.14 -41.59 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.56 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -64.79 -37.82 88.9 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.514 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -68.39 -50.67 51.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.131 0.491 . . . . 0.0 111.141 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . 0.804 ' OD1' ' N ' ' A' ' 154' ' ' VAL . 56.5 p30 -72.45 -38.43 68.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.865 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.804 ' N ' ' OD1' ' A' ' 153' ' ' ASN . 40.1 t -61.02 -46.45 96.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 155' ' ' LEU . 71.4 mt -64.21 -43.19 95.79 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.401 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.451 ' O ' ' OG ' ' A' ' 160' ' ' SER . 20.1 mt -62.37 -43.86 97.83 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.609 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.3 -31.54 71.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.105 0.479 . . . . 0.0 110.185 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 66.6 m -63.75 -50.89 67.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.884 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.404 HD12 ' N ' ' A' ' 160' ' ' SER . 1.7 pp -77.11 -31.06 55.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.663 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.451 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 74.4 m -60.3 -42.15 94.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.686 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.405 ' C ' ' H ' ' A' ' 163' ' ' GLU . 97.8 mtt180 -61.97 -44.26 97.11 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.947 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.642 ' O ' HG22 ' A' ' 162' ' ' THR . 35.6 m -77.91 36.36 0.22 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.754 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 161' ' ' ARG . 80.8 tt0 -141.07 -31.24 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.943 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.454 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 69.1 tt0 -102.7 24.39 10.62 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.398 0.618 . . . . 0.0 109.935 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.684 HG23 ' O ' ' A' ' 165' ' ' ILE . 8.2 tp -56.0 104.95 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.731 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 54.2 m170 45.98 30.51 0.92 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.13 0.49 . . . . 0.0 110.111 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -81.86 89.0 6.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.479 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -101.49 14.14 32.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.285 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 11.8 t -93.58 133.37 34.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.62 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 17.9 tt -119.13 137.97 51.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.458 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . 0.516 ' O ' ' N ' ' A' ' 173' ' ' SER . 6.9 t -136.5 85.9 24.65 Favored Pre-proline 0 C--O 1.232 0.154 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.504 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -38.88 87.38 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.456 0 C-N-CA 122.692 2.262 . . . . 0.0 112.038 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.516 ' N ' ' O ' ' A' ' 171' ' ' SER . 8.0 t -114.48 133.96 55.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.473 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -58.78 -10.12 2.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.974 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.538 ' O ' ' CG1' ' A' ' 178' ' ' ILE . 0.5 OUTLIER -169.47 52.94 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.732 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.639 ' O ' ' N ' ' A' ' 178' ' ' ILE . 2.7 m 59.44 144.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.834 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -60.39 64.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.567 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.639 ' N ' ' O ' ' A' ' 176' ' ' SER . 3.7 pt -128.32 147.17 32.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.8 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -63.97 -41.4 97.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.311 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 88.13 89.12 1.12 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.539 ' C ' ' NE2' ' A' ' 184' ' ' HIS . 24.7 m -166.74 0.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.658 0.266 . . . . 0.0 110.735 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 9.2 t -146.3 -24.52 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.713 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 183' ' ' LEU . 4.2 mm? -63.42 -40.02 96.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.976 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.539 ' NE2' ' C ' ' A' ' 181' ' ' SER . 9.1 p80 -49.79 -41.22 43.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.355 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 11.2 t -61.86 -45.09 95.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.185 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.637 ' O ' HD13 ' A' ' 190' ' ' LEU . 94.8 mtt-85 -61.16 -45.12 95.93 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.071 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 31.6 m-70 -64.27 -35.41 80.75 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.028 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 55.2 m -62.32 -43.93 97.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.985 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -62.71 -41.08 98.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.7 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.637 HD13 ' O ' ' A' ' 186' ' ' ARG . 9.5 mp -62.12 -42.92 99.71 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.623 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.525 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 23.7 mmtp -67.51 -39.54 85.14 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 83.0 tt0 -67.79 -47.68 68.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.997 0.427 . . . . 0.0 111.66 -179.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.554 ' HZ2' ' HA ' ' A' ' 190' ' ' LEU . 1.0 OUTLIER -73.13 -43.12 62.08 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.415 -179.315 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.741 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.94 -42.09 77.21 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.053 -179.648 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.59 ' CZ ' HE22 ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.51 -39.25 93.43 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.43 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 49.9 m -60.46 -43.76 96.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.41 -43.23 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.9 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -62.3 -41.53 98.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.847 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.59 HE22 ' CZ ' ' A' ' 195' ' ' ARG . 84.1 mt-30 -63.6 -38.52 91.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.579 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.87 -48.83 84.13 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 26.8 mt -62.84 -39.71 95.22 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.129 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.566 ' HB3' HH12 ' A' ' 206' ' ' ARG . 48.8 m-20 -62.31 -37.45 85.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.482 0.658 . . . . 0.0 109.419 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.419 ' HD2' ' C ' ' A' ' 203' ' ' ARG . 4.1 tmm_? -61.66 -41.96 98.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.145 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.721 HD21 ' OE1' ' A' ' 141' ' ' GLU . 21.5 mt -61.14 -39.62 90.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.434 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 70.7 mtp85 -60.95 -43.72 98.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.746 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.68 ' O ' ' N ' ' A' ' 210' ' ' GLN . 84.7 mtt85 -64.54 -39.8 94.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.234 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.604 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.1 t -63.62 -45.58 97.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.077 0.465 . . . . 0.0 110.236 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.06 -29.55 64.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.72 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -96.85 -16.75 20.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.274 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.68 ' N ' ' O ' ' A' ' 206' ' ' ARG . 18.8 mm100 -127.66 -37.89 1.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.781 0.324 . . . . 0.0 110.697 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.604 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -66.57 3.16 3.82 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.442 ' OH ' ' HB2' ' A' ' 124' ' ' ALA . 2.5 m-85 -91.68 168.74 11.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.882 0.372 . . . . 0.0 110.502 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 7.0 m -72.01 -5.62 36.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.429 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 35.1 p -68.67 142.33 55.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.592 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.419 ' O ' ' HB3' ' A' ' 216' ' ' ALA . 76.1 mt-10 -138.78 151.96 47.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.928 0.394 . . . . 0.0 110.301 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 215' ' ' GLU . . . 64.93 121.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.862 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -146.84 15.85 1.22 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.577 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.514 ' CD1' HG21 ' A' ' 224' ' ' ILE . 77.3 m-85 -62.12 -141.06 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 121.049 0.452 . . . . 0.0 110.125 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.569 ' HB3' HG11 ' A' ' 223' ' ' VAL . 47.6 tp10 -57.44 -43.54 84.01 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 119.931 -0.707 . . . . 0.0 109.123 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.666 ' O ' HG12 ' A' ' 223' ' ' VAL . 18.2 tt0 -170.21 131.39 0.95 Allowed Pre-proline 0 CA--C 1.533 0.305 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.778 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.419 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 76.5 Cg_exo -47.17 79.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.668 2.245 . . . . 0.0 112.233 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.564 ' N ' ' O ' ' A' ' 220' ' ' GLU . 0.7 OUTLIER 165.38 -46.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.606 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 1.046 HG13 ' H ' ' A' ' 224' ' ' ILE . 2.1 p -61.48 -84.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.42 0.629 . . . . 0.0 111.228 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 1.046 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.1 mp -52.97 -26.66 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.062 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -63.15 -46.45 87.12 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.326 0.584 . . . . 0.0 109.864 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 17.5 mt -61.76 -40.75 96.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.362 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.437 ' N ' ' CD1' ' A' ' 227' ' ' TRP . 40.8 m0 -61.24 -37.1 81.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.957 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . 0.498 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 66.4 t0 -63.48 -37.17 86.28 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' A' ' 230' ' ' ALA . 95.7 mt -64.53 -42.24 95.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.442 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.587 ' O ' ' N ' ' A' ' 233' ' ' ALA . . . -29.97 -70.25 0.06 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.298 -179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 4.1 pt20 -38.0 -47.82 1.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.444 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.443 ' N ' ' O ' ' A' ' 229' ' ' LEU . 6.2 m -86.17 31.88 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.357 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . 0.587 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -150.51 111.06 4.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . 0.666 ' O ' ' HB2' ' A' ' 235' ' ' LEU . 65.0 t30 48.12 -142.6 0.48 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.228 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' A' ' 234' ' ' ASN . 60.6 mt 85.93 148.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.926 0.766 . . . . 0.0 110.746 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.624 ' H ' ' CD ' ' A' ' 239' ' ' GLU . 0.9 OUTLIER -100.23 -119.86 0.16 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.511 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . 0.568 ' N ' ' OE1' ' A' ' 239' ' ' GLU . 32.6 p-10 -122.06 -62.49 1.39 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.864 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.67 -42.16 99.48 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.185 0.517 . . . . 0.0 110.794 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.747 ' HB2' ' ND1' ' A' ' 320' ' ' HIS . 3.2 pm0 -58.5 -29.19 66.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.691 179.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.588 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -67.17 -57.89 5.9 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.002 -179.153 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -55.37 -49.45 72.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.515 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.41 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.059 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 1.5 t80 -62.12 -44.86 95.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.238 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 59.4 ttm-85 -57.9 -48.54 79.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.972 0.415 . . . . 0.0 110.355 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.5 -39.27 85.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.628 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -58.9 -55.02 40.57 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.331 0.586 . . . . 0.0 110.344 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.443 ' N ' ' CD2' ' A' ' 247' ' ' LEU . 3.9 mm? -63.91 -34.31 77.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.71 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.7 tttt -57.73 -43.15 85.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 110.265 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -68.57 -43.59 76.25 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.351 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.6 -47.66 82.8 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.504 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.71 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.5 pp20? -60.82 -38.0 83.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.079 0.466 . . . . 0.0 109.756 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.01 -39.07 89.96 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.495 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -63.17 -47.43 82.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.487 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.446 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.3 tt -63.36 -34.83 69.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.072 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.77 -45.44 89.76 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.179 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.02 -43.35 99.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.139 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -43.44 79.41 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.015 0.436 . . . . 0.0 109.976 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -61.02 -41.29 96.27 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.311 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -58.93 -46.28 88.36 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.107 0.479 . . . . 0.0 110.355 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -61.18 -40.84 95.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.119 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.682 HE21 ' CG2' ' A' ' 297' ' ' THR . 88.2 mm-40 -56.47 -44.15 80.29 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.011 0.434 . . . . 0.0 110.089 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.3 -45.32 94.97 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.059 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -60.06 -38.32 82.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.11 -42.39 99.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.373 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -61.17 -47.55 85.67 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.058 0.456 . . . . 0.0 110.476 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.239 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.68 88.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -60.53 -49.21 78.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.357 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -62.7 -44.87 95.13 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.53 -39.8 92.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.566 HD21 ' OE2' ' A' ' 275' ' ' GLU . 4.2 tt -60.72 -45.43 94.26 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.448 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -61.78 -40.23 94.44 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.55 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 12.1 m80 -71.34 -41.39 69.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.914 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -67.97 -41.64 82.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.985 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . 0.566 ' OE2' HD21 ' A' ' 271' ' ' LEU . 92.5 mt-10 -56.94 -17.62 10.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.57 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 29.5 m -61.16 -43.99 98.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.628 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.519 HG13 ' N ' ' A' ' 279' ' ' ASP . 2.1 p -66.87 -35.9 75.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.507 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 76.69 37.65 34.0 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . 0.519 ' N ' HG13 ' A' ' 277' ' ' VAL . 59.9 t0 -59.79 -44.0 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.845 0.355 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 81.87 -4.12 76.51 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -94.04 -69.9 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.905 0.383 . . . . 0.0 110.375 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -70.77 -20.84 62.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.773 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 58.6 t -62.04 -47.83 91.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.587 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 46.5 t -63.94 -44.53 92.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.047 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.8 -42.31 99.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.649 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . 0.421 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 39.9 t -62.32 -46.72 87.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.628 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -64.58 -39.55 93.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.949 0.404 . . . . 0.0 110.742 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -58.66 -58.11 10.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.153 0.502 . . . . 0.0 110.167 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.491 ' HD3' HD23 ' A' ' 292' ' ' LEU . 35.2 mmtt -64.47 -31.98 73.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.901 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . 0.421 ' HB2' ' O ' ' A' ' 286' ' ' SER . 58.1 t-80 -54.49 -51.34 65.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.865 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.32 82.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.462 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.491 HD23 ' HD3' ' A' ' 289' ' ' LYS . 15.6 tp -62.04 -49.63 75.24 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.779 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.85 -41.67 99.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.941 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.465 ' O ' ' OG1' ' A' ' 297' ' ' THR . 68.8 mm-40 -61.09 -38.06 84.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.078 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.9 -45.22 96.13 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 16.8 tpp85 -61.21 -43.46 98.85 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.693 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.682 ' CG2' HE21 ' A' ' 261' ' ' GLN . 31.5 p -60.22 -43.5 95.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.433 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -63.89 -45.12 90.8 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.449 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.39 -40.78 97.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.267 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -44.08 97.64 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.186 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.8 -41.28 97.55 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -61.35 -46.03 91.94 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.157 0.503 . . . . 0.0 110.719 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . 0.484 HG22 ' ND1' ' A' ' 307' ' ' HIS . 19.7 m -60.8 -44.38 96.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.56 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -61.08 -43.16 95.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.346 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.22 -49.55 76.66 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.111 0.481 . . . . 0.0 110.803 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -62.13 -44.37 96.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.458 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.484 ' ND1' HG22 ' A' ' 303' ' ' THR . 19.4 m80 -66.82 -31.09 71.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.151 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.552 HD21 HG23 ' A' ' 223' ' ' VAL . 0.5 OUTLIER -60.07 -47.9 83.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.064 -179.6 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.49 -44.14 71.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.808 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . 0.488 ' O ' ' NH1' ' A' ' 319' ' ' ARG . 95.4 m-20 -59.68 -51.93 67.67 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.013 0.435 . . . . 0.0 111.089 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 315' ' ' ILE . 36.4 mt -62.57 -48.21 80.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.783 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 8.0 m -69.52 -12.89 62.02 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.693 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -79.57 -64.43 1.9 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.456 ' HB2' HH11 ' A' ' 319' ' ' ARG . 89.5 mmt-85 -68.76 -37.6 79.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.01 0.405 . . . . 0.0 110.972 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.708 HD13 ' O ' ' A' ' 318' ' ' ALA . 1.2 mm -57.5 -19.88 12.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.748 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . 0.467 ' C ' ' O ' ' A' ' 315' ' ' ILE . 82.0 p -36.67 -33.8 0.06 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.505 HH11 ' HB3' ' A' ' 318' ' ' ALA . 0.1 OUTLIER -114.22 -36.56 4.66 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.924 177.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.788 ' HB1' ' CD2' ' A' ' 320' ' ' HIS . . . -176.42 -71.4 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.777 ' O ' ' ND1' ' A' ' 320' ' ' HIS . 40.0 ttt85 72.3 -76.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.221 0.534 . . . . 0.0 111.702 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . 0.788 ' CD2' ' HB1' ' A' ' 318' ' ' ALA . 0.0 OUTLIER 53.62 -49.55 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.815 -179.745 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.758 ' N ' ' O ' ' A' ' 319' ' ' ARG . 9.6 t-20 144.49 -12.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -68.11 -34.95 77.33 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.358 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.6 HD22 ' HA ' ' A' ' 319' ' ' ARG . 9.1 mp . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.058 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 4' ' ' GLU . 87.0 p -157.18 159.08 37.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.464 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.466 ' C ' ' O ' ' A' ' 2' ' ' SER . 88.8 mtm180 33.34 32.3 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.516 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.543 ' N ' ' O ' ' A' ' 2' ' ' SER . 16.8 pt-20 -65.88 -39.95 91.13 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.77 0.319 . . . . 0.0 110.521 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.9 tttm -163.51 153.89 15.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.469 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -67.79 131.13 44.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.204 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -138.44 130.48 15.86 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.499 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.51 157.71 48.66 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.395 2.063 . . . . 0.0 112.391 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.1 tptt 55.41 76.22 0.53 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.791 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.48 157.62 52.58 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.439 2.092 . . . . 0.0 112.167 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.9 t -161.04 74.44 2.61 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.713 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -61.2 145.01 99.13 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.858 2.372 . . . . 0.0 112.164 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -136.4 117.12 14.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.503 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 16' ' ' SER . 34.4 ptt-85 -163.44 -158.69 0.48 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.644 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.09 53.3 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.841 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.529 ' N ' ' O ' ' A' ' 14' ' ' ARG . 17.4 m -75.06 148.71 39.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.194 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -132.6 64.56 0.6 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 111.086 -0.805 . . . . 0.0 111.086 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -125.07 112.98 17.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.847 0.356 . . . . 0.0 110.543 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.53 ' N ' ' OE1' ' A' ' 19' ' ' GLU . 57.0 mp0 -99.42 -8.91 24.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.48 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -136.09 165.28 26.08 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.966 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.507 HH21 ' CD ' ' A' ' 53' ' ' GLU . 80.4 mtm180 -64.19 -36.61 84.62 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.505 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 30.6 mtp -125.0 147.88 48.73 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.648 0.737 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.772 ' CD ' ' H ' ' A' ' 23' ' ' GLU . 2.0 pm0 -59.15 -32.03 69.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.86 -50.13 73.39 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.31 0.576 . . . . 0.0 110.588 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 25' ' ' LEU . 10.8 mp -61.33 -38.74 87.99 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.286 179.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.414 ' OD1' ' O ' ' A' ' 26' ' ' ASN . 55.1 t-20 -63.45 -37.6 87.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.333 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.36 -48.25 82.55 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.297 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.1 mm? -61.06 -42.43 98.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.115 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.567 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 54.6 t-105 -61.81 -43.53 98.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -57.55 -44.25 85.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.207 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -61.42 -41.29 96.93 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.107 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.11 87.2 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.147 0.498 . . . . 0.0 110.129 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.567 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -63.43 -37.68 88.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.075 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -59.91 -44.37 94.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.317 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.36 -39.65 94.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.381 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.46 104.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.798 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.7 mt -121.95 154.3 61.01 Favored Pre-proline 0 C--O 1.233 0.214 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.616 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -40.53 154.11 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.513 2.142 . . . . 0.0 112.377 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.5 -43.67 49.15 Favored 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.521 2.147 . . . . 0.0 112.62 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -48.34 88.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.812 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -66.23 -38.54 88.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.564 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.9 tt -63.63 -43.56 96.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.66 -47.87 76.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.757 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -66.71 -41.81 87.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.614 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.507 HD13 ' OH ' ' A' ' 88' ' ' TYR . 51.4 tp -62.54 -48.57 78.92 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.541 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -60.25 -41.63 93.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.289 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.4 90.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.744 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.409 ' OD1' ' C ' ' A' ' 48' ' ' ASP . 61.3 t0 -60.4 -53.28 59.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.394 . . . . 0.0 110.688 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.86 -39.68 95.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.206 0.527 . . . . 0.0 110.487 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -56.8 -46.79 81.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.133 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.09 -42.49 96.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.679 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -49.57 -45.58 47.9 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.507 ' CD ' HH21 ' A' ' 21' ' ' ARG . 42.1 tp10 -66.99 -36.47 82.24 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.359 -0.537 . . . . 0.0 109.599 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.59 -46.41 89.96 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -64.24 -40.08 95.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.503 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.6 -49.75 74.01 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.983 0.42 . . . . 0.0 110.259 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.82 -42.34 97.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.428 -0.509 . . . . 0.0 109.861 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.78 96.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -57.09 -42.66 81.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.202 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.59 -45.25 94.68 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.72 -45.43 81.89 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.256 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mp -62.36 -42.29 99.28 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.262 -0.575 . . . . 0.0 109.996 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -55.83 -43.99 77.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 41.1 tp -63.14 -39.49 94.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.757 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -62.64 -19.5 63.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.017 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.73 21.98 10.71 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 83.4 mt -106.44 -169.38 1.56 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.077 0.465 . . . . 0.0 110.152 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.2 t70 54.21 97.92 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.568 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -125.37 -35.85 2.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.702 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.15 -36.28 83.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.648 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 85.73 12.26 72.36 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -69.29 -36.95 77.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.737 0.303 . . . . 0.0 110.326 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -59.99 -59.58 5.19 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.961 0.41 . . . . 0.0 110.553 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 16.4 pt-20 -57.19 -40.03 76.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.129 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.41 ' N ' ' HG3' ' A' ' 74' ' ' GLU . . . -59.6 -41.31 90.06 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.257 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -63.15 -42.28 99.42 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 77' ' ' LEU . 92.4 mt -63.63 -43.68 96.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.161 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.57 -45.48 97.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.312 0.577 . . . . 0.0 110.06 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.605 ' O ' HG23 ' A' ' 83' ' ' VAL . 42.3 ttm180 -59.46 -43.1 93.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.135 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.417 ' O ' HG13 ' A' ' 84' ' ' ILE . 96.0 m-20 -62.09 -39.68 93.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.374 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.612 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.72 -48.92 79.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.312 0.577 . . . . 0.0 109.874 -179.503 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -64.54 -38.74 92.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.323 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 79' ' ' ARG . 70.4 t -63.5 -46.19 95.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.649 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.35 -49.49 83.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.313 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.62 -39.89 88.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.868 0.366 . . . . 0.0 110.788 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -58.36 -50.26 74.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.787 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.92 -43.87 97.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.806 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.507 ' OH ' HD13 ' A' ' 45' ' ' LEU . 4.8 m-85 -62.91 -27.06 69.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.311 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.35 22.64 78.56 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.8 mt -100.3 16.25 24.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.93 0.395 . . . . 0.0 110.612 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -80.06 -83.43 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -77.76 171.39 55.15 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.206 -0.757 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -141.14 131.51 25.15 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.723 0.297 . . . . 0.0 110.571 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.581 ' O ' ' N ' ' A' ' 96' ' ' ALA . 12.5 tttt 50.16 94.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.864 0.364 . . . . 0.0 110.293 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 96' ' ' ALA . 28.7 t70 45.86 -85.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.591 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 94' ' ' LYS . . . 175.13 170.3 0.29 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.804 0.335 . . . . 0.0 110.557 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.39 149.77 28.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.635 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -160.88 -24.28 0.06 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.409 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.5 t -86.41 100.48 9.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.859 0.361 . . . . 0.0 110.4 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 10.7 t -154.49 149.22 26.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.469 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.1 t -118.31 108.5 15.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.562 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.415 ' O ' ' O ' ' A' ' 103' ' ' SER . 85.9 m-20 -65.23 -41.26 94.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.811 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 102' ' ' ASN . 4.0 m 50.74 102.4 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.799 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.2 mp 58.17 -172.39 0.1 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.675 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 52.1 m -60.0 -43.34 95.25 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.925 0.393 . . . . 0.0 110.814 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 63.44 29.99 76.24 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 11.9 p -72.16 136.31 46.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.811 0.338 . . . . 0.0 110.755 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -137.43 125.76 23.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.336 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -98.06 137.48 36.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.685 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -65.68 -40.55 92.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.556 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 179.76 -85.83 0.07 OUTLIER Glycine 0 N--CA 1.463 0.438 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 112' ' ' LEU . 33.8 tp -141.31 130.81 23.87 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.618 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.427 ' O ' ' CG ' ' A' ' 114' ' ' ASP . 91.7 m-20 -80.76 61.85 4.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.427 ' CG ' ' O ' ' A' ' 113' ' ' ASP . 13.6 m-20 -163.77 86.97 1.22 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.487 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -49.55 -33.7 31.53 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.63 2.22 . . . . 0.0 112.192 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -64.35 -41.38 96.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.942 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 80.8 mt -81.74 -27.07 34.03 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.151 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.5 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 94.9 mt-10 -54.56 -28.68 47.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.476 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.8 mttt -62.37 -48.14 81.1 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.795 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.53 -44.41 78.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.439 . . . . 0.0 112.013 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.683 ' CE2' HD13 ' A' ' 135' ' ' LEU . 10.3 t-105 -56.54 -53.67 54.83 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.795 -178.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.5 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 8.2 m-70 -67.6 -31.8 72.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.49 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.586 ' O ' ' OG ' ' A' ' 127' ' ' SER . 13.8 tptt -57.33 -50.68 72.19 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.052 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.09 -46.84 64.04 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.806 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -50.6 -48.08 57.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.004 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.2 m -85.05 -39.35 18.1 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.603 ' O ' ' CE2' ' A' ' 212' ' ' TYR . 17.0 m -45.75 -30.86 1.76 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.096 -178.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -152.67 -90.17 0.08 OUTLIER Glycine 0 N--CA 1.464 0.541 0 C-N-CA 119.993 -1.099 . . . . 0.0 111.184 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.78 23.3 0.06 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.444 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -67.5 50.48 0.05 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.401 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.476 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.3 m -104.3 118.48 36.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.013 0.435 . . . . 0.0 111.812 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 111.94 -98.04 0.97 Allowed Glycine 0 CA--C 1.53 1.008 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.531 178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.535 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 12.8 pt-20 -73.78 -42.16 61.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.213 0.53 . . . . 0.0 111.149 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.458 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.7 mp0 -59.24 -48.29 82.18 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.258 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.683 HD13 ' CE2' ' A' ' 121' ' ' TRP . 3.0 mt -62.08 -40.48 95.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.127 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.535 ' OD2' ' HA ' ' A' ' 133' ' ' GLU . 0.0 OUTLIER -62.12 -39.31 92.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.075 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -63.1 -43.94 97.08 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 110.02 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.8 mm? -59.95 -42.21 93.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -33.54 76.14 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.69 177.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.589 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 82.0 mmt-85 -58.67 -41.48 86.25 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -69.67 -40.55 76.34 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.568 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -58.93 -58.45 8.58 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.137 0.494 . . . . 0.0 110.481 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.47 -36.97 77.01 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.049 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.589 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 49.0 m170 -54.17 -42.4 69.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.582 ' O ' HG12 ' A' ' 149' ' ' VAL . 4.6 m-70 -65.98 -36.81 84.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 178.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.85 -45.89 90.99 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.47 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.7 pt-20 -71.42 -47.89 53.05 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.412 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.435 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 49.0 mtmt -63.2 -46.64 86.08 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.178 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.582 HG12 ' O ' ' A' ' 145' ' ' HIS . 6.5 p -62.86 -36.5 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.224 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.696 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -65.33 -40.6 93.88 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.402 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 155' ' ' LEU . 79.2 mm-40 -64.27 -39.87 94.82 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.534 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.445 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 22.1 m-85 -62.54 -49.13 76.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . 0.535 ' OD1' ' HA ' ' A' ' 150' ' ' HIS . 0.9 OUTLIER -74.57 -42.57 58.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.003 0.43 . . . . 0.0 111.004 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 150' ' ' HIS . 70.8 t -61.61 -45.65 98.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.892 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.413 ' CG ' ' O ' ' A' ' 151' ' ' GLU . 77.9 mt -64.26 -42.57 96.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.197 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 18.3 mt -62.68 -43.54 98.54 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.671 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.405 ' O ' ' OG ' ' A' ' 160' ' ' SER . 96.6 mt-10 -68.36 -27.61 66.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.034 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 57.9 m -69.68 -48.77 58.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.172 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 pp -78.21 -24.56 47.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.661 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.405 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 85.2 p -58.02 -38.57 76.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.384 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -65.75 -39.74 91.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.755 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 3.2 m -81.3 36.57 0.42 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.696 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -123.44 -40.98 2.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.946 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 76.3 tt0 -85.4 23.46 1.32 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.356 0.598 . . . . 0.0 110.07 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.683 HG23 ' O ' ' A' ' 165' ' ' ILE . 7.0 tp -56.81 92.24 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.6 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 m170 50.42 25.03 1.75 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.129 0.49 . . . . 0.0 109.974 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.19 91.98 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.593 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.521 ' H ' ' ND2' ' A' ' 168' ' ' ASN . 0.5 OUTLIER -114.13 21.08 15.1 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.576 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 59.8 t -116.95 127.76 74.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.843 0.354 . . . . 0.0 110.448 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 170' ' ' ILE . 19.6 tt -141.78 132.33 25.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.598 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.91 160.08 41.47 Favored Pre-proline 0 N--CA 1.456 -0.16 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.275 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.608 ' O ' ' O ' ' A' ' 173' ' ' SER . 62.8 Cg_exo -47.13 -54.46 4.99 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.498 2.132 . . . . 0.0 112.31 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.608 ' O ' ' O ' ' A' ' 172' ' ' PRO . 1.0 OUTLIER 44.45 111.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.991 0.424 . . . . 0.0 110.627 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -54.12 -41.02 67.87 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 177' ' ' ASP . 1.8 tt -153.56 104.45 2.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.401 ' N ' HD23 ' A' ' 175' ' ' LEU . 14.8 t 50.15 -85.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.769 0.319 . . . . 0.0 110.407 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.561 ' N ' ' O ' ' A' ' 175' ' ' LEU . 45.9 p-10 -162.76 24.46 0.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.916 0.389 . . . . 0.0 110.85 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.669 ' O ' HD12 ' A' ' 178' ' ' ILE . 1.1 pp -146.64 159.51 10.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.923 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -88.58 46.83 1.42 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.398 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 78.89 12.09 84.53 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 12.4 t -62.63 -44.25 96.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.789 0.328 . . . . 0.0 110.683 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.701 HG12 ' H ' ' A' ' 183' ' ' LEU . 2.1 t -141.24 -144.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.611 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.701 ' H ' HG12 ' A' ' 182' ' ' VAL . 5.3 tp 63.91 -36.31 0.17 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.154 0.502 . . . . 0.0 110.828 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.752 ' CD2' ' H ' ' A' ' 185' ' ' SER . 0.6 OUTLIER -56.11 -41.0 74.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.715 -179.677 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.752 ' H ' ' CD2' ' A' ' 184' ' ' HIS . 10.7 t -60.64 -45.16 95.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.456 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.74 -45.49 93.72 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.84 0.353 . . . . 0.0 110.749 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 31.4 m-70 -66.79 -34.81 78.64 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.243 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . 0.436 ' CG2' ' OE2' ' A' ' 192' ' ' GLU . 54.6 m -61.95 -43.87 97.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.169 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -65.12 -40.52 94.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.114 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 194' ' ' LEU . 3.6 mt -62.15 -46.25 89.82 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.882 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 66.2 mttm -71.73 -40.71 69.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.442 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.436 ' OE2' ' CG2' ' A' ' 188' ' ' THR . 94.1 mt-10 -68.51 -43.76 76.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.827 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.467 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 22.6 pttt -72.31 -43.81 63.64 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.215 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.812 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.02 -42.9 72.38 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.777 -179.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.526 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -66.03 -37.05 84.9 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 57.7 m -59.37 -42.55 91.91 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.41 ' OD1' ' C ' ' A' ' 198' ' ' ASN . 32.8 t-20 -62.54 -42.53 99.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.768 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -64.93 -34.15 77.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.381 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.05 -46.79 92.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.281 -1.127 . . . . 0.0 110.281 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 204' ' ' LEU . 30.2 mt -62.69 -42.26 99.54 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.376 -0.53 . . . . 0.0 109.946 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -62.88 -36.66 84.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.471 ' O ' ' HD2' ' A' ' 203' ' ' ARG . 15.4 tpt180 -64.23 -41.56 96.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.821 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.507 HD12 HD23 ' A' ' 201' ' ' LEU . 81.9 mt -59.25 -38.52 80.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -65.58 -42.15 92.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.623 ' O ' ' N ' ' A' ' 210' ' ' GLN . 79.1 mtt85 -65.74 -36.74 84.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.087 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.651 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.33 -45.99 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.04 0.448 . . . . 0.0 110.127 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 90.0 p -70.25 -27.25 64.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.539 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -98.06 -14.22 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.623 ' N ' ' O ' ' A' ' 206' ' ' ARG . 53.3 tt0 -137.17 -36.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.775 0.322 . . . . 0.0 110.745 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.651 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -66.88 33.84 0.18 Allowed Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.603 ' CE2' ' O ' ' A' ' 127' ' ' SER . 23.9 t80 -61.19 -44.53 97.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.096 0.474 . . . . 0.0 110.03 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 176.95 -71.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.731 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 66.0 p 47.94 19.39 0.18 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.925 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 45.3 -165.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.656 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . 0.495 ' O ' ' CB ' ' A' ' 217' ' ' GLU . . . -101.61 -69.14 0.79 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.977 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.525 ' O ' ' C ' ' A' ' 218' ' ' PHE . 23.0 tp10 83.87 8.96 0.54 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.693 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.525 ' C ' ' O ' ' A' ' 217' ' ' GLU . 72.5 m-85 24.77 86.15 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.884 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -176.37 -28.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.187 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.631 ' O ' ' O ' ' A' ' 221' ' ' PRO . 3.1 tm-20 -59.19 128.91 85.99 Favored Pre-proline 0 C--N 1.329 -0.325 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.236 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.668 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 76.8 Cg_exo -47.09 -155.9 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.611 2.207 . . . . 0.0 111.772 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.668 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 83.5 mtp180 85.81 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.71 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.618 HG13 ' N ' ' A' ' 224' ' ' ILE . 7.5 p -61.07 -51.71 70.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.618 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.6 OUTLIER -64.35 -32.72 58.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.332 0.586 . . . . 0.0 109.516 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -63.25 -39.35 94.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.477 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.522 ' HA ' HD12 ' A' ' 229' ' ' LEU . 10.7 mt -61.29 -40.89 95.83 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.577 ' CH2' HD23 ' A' ' 308' ' ' LEU . 43.6 m0 -59.61 -40.08 86.33 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.029 -0.668 . . . . 0.0 110.057 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' ' 231' ' ' GLN . 49.6 m-20 -63.52 -36.94 85.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.654 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.599 ' C ' ' H ' ' A' ' 231' ' ' GLN . 13.0 mt -63.85 -41.07 97.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.311 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -59.2 4.95 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.974 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.714 ' O ' HD21 ' A' ' 240' ' ' LEU . 5.4 pt20 -64.27 -40.96 97.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.839 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 18.8 p -154.03 23.39 0.5 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.522 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -60.87 -47.63 85.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.677 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -176.9 65.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.55 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 235' ' ' LEU . 94.1 mt -133.42 157.11 46.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.083 0.468 . . . . 0.0 110.675 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 22.0 p -78.95 171.23 15.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.49 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -64.55 -45.25 87.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.996 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.91 -45.61 92.99 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.25 0.548 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.455 ' HG2' ' HA ' ' A' ' 322' ' ' GLU . 95.8 mt-10 -64.64 -33.79 76.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.696 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.714 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -63.04 -42.8 99.83 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.508 -179.94 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . 0.582 ' OE2' ' NH2' ' A' ' 244' ' ' ARG . 53.1 tp10 -63.73 -47.72 79.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.197 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.95 -42.75 99.47 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.359 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.587 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.1 OUTLIER -69.87 -30.27 67.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.447 179.406 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . 0.582 ' NH2' ' OE2' ' A' ' 241' ' ' GLU . 57.8 ttp180 -65.03 -58.61 5.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.089 0.471 . . . . 0.0 110.691 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -66.32 -39.38 89.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.088 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -57.74 -55.88 29.09 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.304 0.574 . . . . 0.0 110.495 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 247' ' ' LEU . 3.8 mm? -63.77 -33.2 75.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.386 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.641 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.8 tttt -58.75 -42.74 89.57 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.28 0.562 . . . . 0.0 110.272 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . 0.407 ' O ' ' HD3' ' A' ' 253' ' ' LYS . 6.4 m-70 -68.89 -43.67 74.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.241 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -61.27 -50.16 74.16 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.433 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.6 pp20? -60.24 -37.13 79.41 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.7 81.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.548 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . 0.407 ' HD3' ' O ' ' A' ' 249' ' ' HIS . 13.9 mptt -63.55 -48.64 76.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.36 -38.99 83.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.058 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -59.44 -54.7 43.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.291 0.567 . . . . 0.0 110.434 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -63.43 -40.6 97.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.915 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . 0.485 ' NE2' ' O ' ' A' ' 297' ' ' THR . 28.4 t-80 -54.28 -47.2 72.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.12 0.486 . . . . 0.0 109.967 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . 0.4 ' O ' ' HB2' ' A' ' 261' ' ' GLN . 60.4 t-20 -61.64 -41.07 96.98 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.174 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -56.34 -45.5 80.36 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 121.098 0.475 . . . . 0.0 109.947 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -63.79 -34.91 78.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.049 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.467 ' HG3' ' O ' ' A' ' 257' ' ' HIS . 26.6 mt-30 -58.57 -47.59 83.75 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -61.58 -45.87 92.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.103 0.478 . . . . 0.0 109.754 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -64.85 -33.07 75.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.006 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 47.2 tp -62.36 -43.78 98.01 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.92 0.391 . . . . 0.0 110.268 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -65.91 -46.01 79.84 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.208 0.527 . . . . 0.0 110.444 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.18 -43.63 98.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.311 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.99 86.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.135 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.69 -45.55 93.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -60.08 -48.99 79.43 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.217 0.532 . . . . 0.0 110.65 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -62.15 -39.2 91.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.56 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.635 ' O ' HD23 ' A' ' 271' ' ' LEU . 4.8 tt -60.49 -44.26 96.14 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.965 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 63.0 ttm-85 -60.2 -43.12 96.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.157 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -66.48 -39.84 89.0 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.651 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.35 84.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 271' ' ' LEU . 96.1 mt-10 -49.64 -19.18 0.55 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.848 0.356 . . . . 0.0 110.396 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . 0.754 ' O ' ' N ' ' A' ' 278' ' ' GLY . 58.6 m -82.81 -75.89 0.29 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.814 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.506 ' C ' ' O ' ' A' ' 276' ' ' SER . 44.1 t 24.29 -77.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 O-C-N 123.686 0.616 . . . . 0.0 110.831 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.754 ' N ' ' O ' ' A' ' 276' ' ' SER . . . 161.17 -77.67 0.17 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.287 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -86.55 123.05 31.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.883 0.373 . . . . 0.0 110.474 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -67.64 144.1 43.24 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -174.92 -46.42 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -96.1 -6.09 39.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.723 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 67.0 t -62.22 -46.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.512 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.39 -46.19 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.071 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.38 -45.41 94.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.5 t -62.11 -42.82 99.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.635 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -63.22 -40.94 98.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.79 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -60.71 -54.31 46.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.364 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.63 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.8 mmtm -65.09 -33.81 76.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.158 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -57.92 -49.01 78.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.271 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -70.07 -38.22 75.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.747 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.63 HD23 ' HD3' ' A' ' 289' ' ' LYS . 2.7 tp -61.62 -50.24 73.37 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.254 -0.579 . . . . 0.0 110.175 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.55 -41.97 98.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.008 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -62.23 -42.46 99.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.19 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -60.93 -47.77 89.59 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 20.3 tpp85 -61.9 -37.34 84.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.437 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.485 ' O ' ' NE2' ' A' ' 257' ' ' HIS . 3.6 m -59.64 -52.24 66.37 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.399 0.618 . . . . 0.0 110.189 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.14 -39.26 92.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -58.23 -45.64 87.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.294 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -44.11 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.132 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -54.96 -44.29 82.62 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . 0.416 ' OH ' ' HD2' ' A' ' 306' ' ' LYS . 43.5 t80 -62.49 -43.37 98.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.129 0.49 . . . . 0.0 110.665 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . 0.627 HG22 ' ND1' ' A' ' 307' ' ' HIS . 17.9 m -59.08 -44.76 91.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.578 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.06 -41.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.202 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -56.52 -57.09 13.83 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-O 121.44 0.638 . . . . 0.0 111.075 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . 0.416 ' HD2' ' OH ' ' A' ' 302' ' ' TYR . 4.7 mtpt -62.41 -39.94 94.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.723 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.627 ' ND1' HG22 ' A' ' 303' ' ' THR . 4.6 m80 -64.24 -35.7 81.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.106 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.577 HD23 ' CH2' ' A' ' 227' ' ' TRP . 15.4 mt -61.81 -43.93 97.86 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.397 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -67.32 -45.73 75.59 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.998 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.54 -49.67 75.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.963 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.468 ' HA ' HD23 ' A' ' 311' ' ' LEU . 21.9 mt -63.85 -40.63 97.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.856 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 69.4 m -57.7 -43.8 85.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.358 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.49 -43.38 86.94 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 317' ' ' ARG . 7.0 mpt_? -63.66 -45.64 89.22 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.773 0.321 . . . . 0.0 111.058 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -73.17 -23.35 19.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.126 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 38.4 t -59.18 -43.71 92.18 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.547 ' O ' ' O ' ' A' ' 314' ' ' ARG . 10.8 tpp180 -117.02 124.59 49.67 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -115.96 101.35 8.69 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.386 -0.525 . . . . 0.0 112.116 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -78.4 160.43 27.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.582 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.19 4.21 6.01 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.449 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' A' ' 323' ' ' LEU . 10.2 t-20 -118.28 148.23 42.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.212 -0.904 . . . . 0.0 108.578 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.709 ' CD ' ' H ' ' A' ' 322' ' ' GLU . 5.7 mp0 -61.06 78.98 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.575 ' N ' ' O ' ' A' ' 321' ' ' ASN . 0.7 OUTLIER . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 117.983 -1.008 . . . . 0.0 111.061 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.6 t -62.53 139.56 58.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.946 0.403 . . . . 0.0 110.463 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -145.0 149.14 34.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.585 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -131.57 154.08 49.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.422 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.447 ' O ' ' O ' ' A' ' 6' ' ' ASN . 99.2 mttt -128.0 155.28 44.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.323 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.447 ' O ' ' O ' ' A' ' 5' ' ' LYS . 9.9 m120 -56.87 -153.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.953 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.543 ' OE1' ' N ' ' A' ' 7' ' ' GLN . 4.4 mp0 -123.73 83.76 54.04 Favored Pre-proline 0 CA--C 1.531 0.236 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.886 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -62.61 147.27 95.01 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.704 2.269 . . . . 0.0 112.124 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.403 ' NZ ' ' CB ' ' A' ' 9' ' ' LYS . 9.3 mtpm? -130.94 62.03 63.09 Favored Pre-proline 0 N--CA 1.462 0.171 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.65 154.33 59.6 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 122.924 2.416 . . . . 0.0 112.174 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.572 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.2 OUTLIER -94.63 -43.9 0.29 Allowed Pre-proline 0 C--N 1.332 -0.178 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.903 -179.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 11' ' ' SER . 24.6 Cg_exo -61.48 145.58 97.83 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.481 2.121 . . . . 0.0 111.845 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -158.52 -46.22 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.588 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.2 ptt-85 -66.14 -38.53 88.36 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -59.09 -16.9 21.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.612 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -65.69 146.07 55.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.649 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 164.69 132.96 1.42 Allowed Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -127.13 131.58 50.76 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.819 0.342 . . . . 0.0 110.574 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -69.65 -43.76 71.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -98.97 176.77 5.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.765 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -63.74 -39.23 93.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.816 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 93.4 mmm -125.31 153.5 43.18 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.056 0.455 . . . . 0.0 110.875 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -60.75 -37.42 81.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.572 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.6 tttp -58.06 -47.16 83.99 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.261 0.553 . . . . 0.0 110.615 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.05 -39.78 93.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.359 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -64.06 -38.66 91.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.11 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.3 -46.37 88.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.433 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 28' ' ' LEU . 97.0 mt -61.7 -43.19 99.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.094 0.473 . . . . 0.0 109.87 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.597 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 52.6 t-105 -61.62 -43.39 98.94 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.214 0.531 . . . . 0.0 110.233 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -57.66 -42.11 82.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.029 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.58 -41.63 97.7 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.159 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.62 87.46 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.124 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.597 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 78.4 mt-30 -62.89 -36.99 85.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.055 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -60.99 -43.14 99.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.337 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -63.56 -39.67 95.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.384 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.81 106.94 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -130.42 154.82 81.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.795 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -37.96 155.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.776 2.317 . . . . 0.0 112.055 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.64 -39.87 11.18 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.546 2.164 . . . . 0.0 112.248 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.28 -48.68 84.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.999 0.428 . . . . 0.0 110.534 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -68.29 -39.54 82.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.711 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.9 tt -62.9 -44.09 97.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.526 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.65 94.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.274 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -66.87 -46.59 74.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.648 HD12 ' OH ' ' A' ' 88' ' ' TYR . 5.2 tt -63.47 -45.78 89.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.547 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -58.39 -43.34 88.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.107 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 51' ' ' ILE . . . -63.14 -41.71 99.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.642 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -56.55 -51.64 67.81 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.917 0.389 . . . . 0.0 110.734 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.84 -38.57 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.372 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -57.79 -45.07 86.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.201 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 47' ' ' ALA . 2.2 mt -63.5 -42.67 97.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.509 ' NE2' HD22 ' A' ' 80' ' ' ASN . 29.5 mm-40 -51.67 -46.19 63.71 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.673 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -64.62 -38.7 91.89 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.908 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -61.52 -44.59 96.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.96 0.409 . . . . 0.0 110.406 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -62.3 -41.57 98.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.377 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -57.3 -49.55 75.73 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.749 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.09 -41.95 93.57 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.967 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.641 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.601 ' HA ' HD21 ' A' ' 62' ' ' LEU . 53.8 t90 -59.1 -41.98 89.41 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.096 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -63.6 -45.16 91.59 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -57.57 -51.57 68.94 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.73 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 59' ' ' TRP . 2.0 pp -65.34 -39.15 92.03 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.808 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 62' ' ' LEU . 29.1 tptp -58.25 -42.28 86.05 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 38.3 tp -63.03 -40.22 97.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.637 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.83 -23.1 67.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.076 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.8 56.56 0.85 Allowed Glycine 0 C--N 1.335 0.478 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 89.7 mt -132.48 -164.62 1.49 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.822 -0.689 . . . . 0.0 110.346 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.508 ' OD2' ' NE1' ' A' ' 59' ' ' TRP . 43.8 t0 54.23 102.39 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.414 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -113.12 -48.69 2.96 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.842 0.353 . . . . 0.0 110.67 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -62.98 -40.2 97.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.693 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 87.43 11.27 69.28 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -62.42 -31.44 72.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.696 0.284 . . . . 0.0 110.275 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.89 -52.64 64.54 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.047 0.451 . . . . 0.0 110.271 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -61.14 -42.17 98.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.08 179.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.01 90.58 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.239 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -61.19 -43.14 99.35 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.483 HD23 HE22 ' A' ' 52' ' ' GLN . 90.0 mt -62.36 -44.05 97.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.39 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.53 -46.9 91.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 120.97 0.414 . . . . 0.0 110.283 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.715 ' O ' HG23 ' A' ' 83' ' ' VAL . 90.1 mtt-85 -62.88 -42.49 99.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.229 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.509 HD22 ' NE2' ' A' ' 52' ' ' GLN . 33.3 t30 -64.01 -39.67 94.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.449 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.71 -48.55 81.21 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.632 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.403 ' HA ' HD22 ' A' ' 82' ' ' ASN . 10.3 m120 -64.86 -39.32 93.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.586 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 79' ' ' ARG . 79.4 t -62.84 -45.62 98.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.343 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -61.38 -48.61 88.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.583 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.26 -41.61 94.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.893 0.377 . . . . 0.0 110.542 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.52 89.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.721 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -63.41 -47.95 79.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.596 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.648 ' OH ' HD12 ' A' ' 45' ' ' LEU . 17.9 m-85 -68.87 -30.9 69.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.505 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.48 25.26 36.58 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.92 8.04 42.75 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.529 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 47.1 p-10 -82.89 45.97 1.05 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.394 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.68 149.07 51.5 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 111.224 -0.75 . . . . 0.0 111.224 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt -127.59 -31.4 2.48 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.664 0.269 . . . . 0.0 110.654 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -117.58 148.37 41.97 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.591 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -114.22 163.29 15.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.794 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -157.56 67.35 0.5 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.527 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -133.43 138.22 46.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.562 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -143.3 -66.21 0.37 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.571 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 4.6 t 43.95 -118.65 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.458 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 56.4 p -143.51 -159.7 1.02 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.262 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 98.6 p -131.96 157.38 44.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.394 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.608 ' O ' ' N ' ' A' ' 104' ' ' LEU . 27.6 t-20 -92.7 106.51 18.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.703 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.4 t 45.37 -84.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.794 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.608 ' N ' ' O ' ' A' ' 102' ' ' ASN . 10.5 mp -76.02 130.31 38.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.942 0.401 . . . . 0.0 110.412 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 61.3 p -64.16 -34.82 78.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.564 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 77.7 63.99 2.12 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 56.7 m -104.64 120.82 42.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.772 0.32 . . . . 0.0 110.359 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 94.1 mm-40 -128.68 45.43 2.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.314 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.425 ' O ' ' OD1' ' A' ' 110' ' ' ASP . 71.5 mm-40 -83.7 120.21 25.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.634 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 109' ' ' GLU . 73.9 m-20 -152.01 117.19 5.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.597 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.36 125.18 4.79 Favored Glycine 0 C--N 1.334 0.421 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.458 ' O ' ' CD ' ' A' ' 118' ' ' GLU . 4.7 mp -60.37 129.74 43.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.048 0.451 . . . . 0.0 110.649 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -73.07 -45.9 54.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.595 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -42.09 116.15 1.67 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.625 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -66.96 -27.66 42.71 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.219 1.946 . . . . 0.0 112.271 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -69.98 -45.74 66.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.806 0.336 . . . . 0.0 111.278 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 53.7 mt -71.02 -37.05 72.6 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.186 0.517 . . . . 0.0 110.865 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.672 ' OE1' ' NE2' ' A' ' 122' ' ' HIS . 27.0 mm-40 -56.04 -25.08 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.194 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 53.4 mttp -61.27 -49.06 78.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.804 -0.759 . . . . 0.0 110.28 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.584 HD13 ' O ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -69.38 -45.09 70.15 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.998 0.428 . . . . 0.0 111.622 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.652 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.6 t-105 -57.72 -49.72 75.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.324 -178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.672 ' NE2' ' OE1' ' A' ' 118' ' ' GLU . 12.6 m-70 -66.27 -35.6 80.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.385 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 127' ' ' SER . 14.0 tptt -55.83 -50.89 69.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.819 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.519 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.46 -47.38 64.16 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.105 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -53.98 -51.85 62.59 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.789 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.1 m -75.02 -43.91 50.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.005 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.519 ' OG ' ' HA ' ' A' ' 124' ' ' ALA . 22.4 p -46.6 -28.16 1.36 Allowed 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -178.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.49 -95.42 0.11 Allowed Glycine 0 CA--C 1.519 0.314 0 C-N-CA 119.996 -1.097 . . . . 0.0 111.525 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 131' ' ' SER . 12.8 pttm -164.04 32.23 0.08 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.563 ' CG ' ' OE1' ' A' ' 134' ' ' GLU . 3.9 m-85 -66.81 49.85 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.469 -179.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.7 m -104.11 124.11 48.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.008 0.433 . . . . 0.0 111.995 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 109.2 -97.49 1.06 Allowed Glycine 0 CA--C 1.53 0.976 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.384 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 134' ' ' GLU . 15.7 pt-20 -78.62 -43.31 26.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.858 0.361 . . . . 0.0 111.329 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.563 ' OE1' ' CG ' ' A' ' 130' ' ' PHE . 56.7 mt-10 -60.58 -51.35 69.8 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.209 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.652 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.4 mt -63.27 -42.86 99.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.502 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -61.17 -42.0 97.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.624 ' HA ' ' HE ' ' A' ' 140' ' ' ARG . 97.1 mttt -61.88 -41.1 97.48 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.167 0.508 . . . . 0.0 110.002 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.66 -41.73 91.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.445 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -66.19 -34.16 77.4 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 177.429 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.624 ' HE ' ' HA ' ' A' ' 137' ' ' LYS . 53.9 mtm180 -57.56 -45.99 84.47 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.842 -1.143 . . . . 0.0 108.202 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -71.9 -38.1 70.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.938 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -58.88 -58.25 9.45 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.786 -179.289 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.65 -40.73 95.96 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.066 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.581 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 47.6 m170 -56.74 -44.34 81.58 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.726 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 149' ' ' VAL . 3.1 m-70 -60.67 -42.39 96.98 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.606 179.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -60.54 -43.48 97.14 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.744 -0.383 . . . . 0.0 111.386 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 151' ' ' GLU . 98.6 mt-10 -65.98 -55.78 15.02 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.703 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.23 -42.68 99.26 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.56 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 145' ' ' HIS . 43.9 t -61.56 -45.42 98.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.144 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.659 ' C ' ' CD2' ' A' ' 150' ' ' HIS . 1.1 p-80 -65.5 -36.27 83.35 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.931 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.602 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 94.2 mt-10 -59.39 -46.23 89.26 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.997 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -61.72 -45.18 95.06 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.684 -0.406 . . . . 0.0 109.955 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.65 -39.29 91.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.15 -47.84 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 62.6 mt -63.52 -42.88 98.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.51 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.453 HD21 HD21 ' A' ' 190' ' ' LEU . 34.2 mt -62.45 -42.7 99.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.539 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.75 -33.22 75.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.952 0.406 . . . . 0.0 110.264 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 65.3 m -65.21 -49.11 70.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.971 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' A' ' 159' ' ' LEU . 1.6 pp -78.95 -21.17 47.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.633 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 36.6 m -60.12 -28.51 67.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.521 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.8 mtp180 -58.11 -44.64 87.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.036 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.614 ' C ' ' H ' ' A' ' 164' ' ' GLU . 12.3 p -83.6 -179.68 7.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.365 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 65.1 -36.93 0.22 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.139 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.614 ' H ' ' C ' ' A' ' 162' ' ' THR . 80.6 tt0 -92.9 57.36 2.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.432 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 18.2 tt -134.84 143.07 38.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.082 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -81.94 109.35 16.21 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -173.62 81.04 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.26 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 11.9 m120 48.03 98.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.95 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 51.9 t -111.3 102.69 14.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.569 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 18.8 tt -169.77 142.82 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.642 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 1.4 p -159.88 154.92 21.36 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.588 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.45 -41.86 64.78 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.57 2.18 . . . . 0.0 112.414 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.46 ' O ' ' OG ' ' A' ' 173' ' ' SER . 9.6 p 57.31 98.37 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -87.38 -23.8 24.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.696 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.659 ' O ' ' N ' ' A' ' 177' ' ' ASP . 7.1 mp -117.0 122.68 44.94 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.545 ' OG ' ' N ' ' A' ' 177' ' ' ASP . 82.0 p 43.7 -85.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.076 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.659 ' N ' ' O ' ' A' ' 175' ' ' LEU . 50.2 p30 -143.6 24.41 1.72 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.879 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 1.5 pp -138.83 156.74 28.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.433 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -62.91 -39.81 95.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.43 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 67.23 140.13 0.06 OUTLIER Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 1.7 m 174.86 -58.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.749 0.309 . . . . 0.0 110.485 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 182' ' ' VAL . 10.9 t -137.99 3.46 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.021 0.438 . . . . 0.0 110.627 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 20.8 mt -62.59 -39.61 94.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -44.73 -39.88 5.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.608 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 74.4 m -61.83 -44.88 95.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.387 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -65.22 -41.55 94.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.265 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -64.85 -40.92 95.93 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.114 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 61.7 m -63.45 -44.58 94.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.966 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -65.65 -41.09 92.98 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.271 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.453 HD21 HD21 ' A' ' 156' ' ' LEU . 7.6 mt -61.97 -47.54 84.38 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.444 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.493 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 55.6 mtmt -70.22 -37.73 75.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.939 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -67.67 -51.02 54.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.488 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 18.4 pttt -67.13 -42.9 83.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.313 -179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.712 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -70.06 -40.49 75.05 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.632 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.5 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 25.3 mmt180 -64.06 -39.5 94.22 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.244 -0.583 . . . . 0.0 109.643 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 78.4 p -62.68 -44.3 96.6 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.456 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 90.0 mt -64.97 -44.4 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.91 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -63.37 -41.56 98.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.826 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 70.6 mt-30 -66.03 -29.54 69.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.123 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.59 -47.22 63.37 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.462 ' HA ' HD23 ' A' ' 201' ' ' LEU . 32.8 mt -64.44 -42.89 95.72 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.873 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.826 ' OD1' ' O ' ' A' ' 199' ' ' GLN . 0.4 OUTLIER -65.85 -35.38 80.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.0 tmt_? -63.42 -42.93 98.74 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.19 -40.57 96.52 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -62.65 -42.66 99.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.867 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.767 ' O ' ' N ' ' A' ' 210' ' ' GLN . 67.9 mtp180 -65.23 -38.34 90.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.064 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 203' ' ' ARG . 52.9 t -64.07 -47.64 89.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.906 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.8 m -71.16 -29.5 65.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.496 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -93.93 -42.27 9.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.372 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.767 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.7 tt0 -105.04 -35.83 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.11 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.459 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . -63.07 -31.87 82.18 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.614 ' O ' ' O ' ' A' ' 213' ' ' SER . 45.6 t80 -42.78 97.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.704 0.287 . . . . 0.0 110.546 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.738 ' O ' ' O ' ' A' ' 214' ' ' THR . 27.9 t 50.11 158.98 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.134 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.738 ' O ' ' O ' ' A' ' 213' ' ' SER . 12.0 t 46.04 150.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.87 0.367 . . . . 0.0 111.01 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.442 ' HG2' ' N ' ' A' ' 216' ' ' ALA . 84.4 tt0 177.03 158.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.283 179.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . 0.442 ' N ' ' HG2' ' A' ' 215' ' ' GLU . . . -150.25 146.06 26.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.394 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -151.0 -6.93 0.26 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.814 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.458 ' O ' ' HB3' ' A' ' 219' ' ' GLU . 96.1 m-85 -122.29 166.33 14.82 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.458 ' HB3' ' O ' ' A' ' 218' ' ' PHE . 82.3 tt0 71.68 -8.86 1.01 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.49 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -56.06 157.47 8.52 Favored Pre-proline 0 C--O 1.232 0.178 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.912 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.484 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 35.3 Cg_exo -56.88 -171.36 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.373 2.049 . . . . 0.0 111.863 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.484 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 0.2 OUTLIER 82.82 -85.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.87 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.998 HG13 ' H ' ' A' ' 224' ' ' ILE . 4.7 p -62.46 -69.22 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.727 0 CA-C-O 121.321 0.581 . . . . 0.0 111.838 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.998 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.5 OUTLIER -56.57 -34.33 41.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . 0.425 ' HB2' ' N ' ' A' ' 222' ' ' ARG . 6.4 m-20 -64.42 -37.0 86.0 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.089 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.45 -42.81 96.9 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.491 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 42.7 m0 -61.73 -38.75 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.15 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -61.54 -38.28 86.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 231' ' ' GLN . 92.3 mt -64.7 -42.06 95.55 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.482 0.658 . . . . 0.0 110.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.452 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -45.38 -19.23 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.902 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.447 ' N ' ' O ' ' A' ' 229' ' ' LEU . 8.9 tt0 -75.13 -69.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.628 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.439 ' O ' ' O ' ' A' ' 233' ' ' ALA . 5.0 m -73.3 -19.05 61.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.562 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -44.04 -96.0 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.668 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -168.87 93.7 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.703 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.452 HD12 ' O ' ' A' ' 230' ' ' ALA . 85.8 mt -141.24 163.83 31.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.649 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.2 p -78.37 166.15 22.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.64 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . 0.421 ' OD1' ' C ' ' A' ' 237' ' ' ASP . 60.0 t0 -66.07 -48.74 69.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.154 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -62.13 -46.74 87.66 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.123 0.487 . . . . 0.0 110.451 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.472 ' OE1' ' O ' ' A' ' 321' ' ' ASN . 80.4 tt0 -62.19 -40.02 94.65 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.292 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 240' ' ' LEU . 17.3 mt -65.54 -34.2 77.7 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.772 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -63.67 -51.87 63.18 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.084 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -65.36 -41.8 93.43 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.344 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.449 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.7 OUTLIER -66.25 -43.06 87.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.403 179.318 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -58.94 -47.55 84.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.195 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -68.18 -42.6 79.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.703 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -57.03 -51.4 69.4 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.13 0.49 . . . . 0.0 110.43 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 2.3 mm? -63.62 -38.92 92.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.529 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 38.4 ttpt -54.82 -45.04 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -66.14 -40.1 90.34 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.552 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . 0.456 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 23.5 t80 -58.07 -50.15 74.44 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.317 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 7.7 pt-20 -62.81 -36.67 83.92 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.86 -38.52 86.51 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.563 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.81 -46.57 87.36 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.243 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -66.08 -39.82 85.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.172 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.19 -46.07 92.0 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.162 0.506 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -61.66 -44.84 96.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.966 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . 0.483 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -54.47 -43.02 71.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . 0.483 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 47.2 t30 -60.8 -41.25 95.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.305 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -59.99 -48.29 82.32 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.521 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -62.32 -36.22 81.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.538 ' OE1' HG21 ' A' ' 297' ' ' THR . 13.1 mm100 -60.58 -42.63 97.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.12 -47.56 85.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.124 0.487 . . . . 0.0 109.86 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -64.06 -35.67 81.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.922 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 62.8 tp -62.04 -41.81 98.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.954 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -63.85 -46.23 85.94 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 110.475 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 67.2 mt -62.74 -43.41 98.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.97 82.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.025 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -61.56 -46.2 90.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -58.09 -48.67 79.45 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.098 0.475 . . . . 0.0 110.119 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -62.46 -35.8 80.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.378 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.689 ' O ' HD23 ' A' ' 271' ' ' LEU . 3.1 tt -59.07 -44.68 91.87 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -179.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -63.84 -41.25 97.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.276 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -66.04 -45.04 82.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.659 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.611 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.32 -34.88 77.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.886 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . 0.544 ' OE2' HG13 ' A' ' 283' ' ' VAL . 41.6 mm-40 -57.67 -31.42 66.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.893 0.377 . . . . 0.0 110.342 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 5.4 m -87.15 6.79 31.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.926 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 274' ' ' ALA . 12.3 p -60.38 -45.27 96.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.759 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.597 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 160.25 -113.0 0.55 Allowed Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -61.32 -47.86 83.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.716 0.294 . . . . 0.0 110.654 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 135.14 -102.77 0.44 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 65.73 -60.43 0.28 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.931 0.396 . . . . 0.0 110.368 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -67.1 -17.33 64.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.281 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . 0.544 HG13 ' OE2' ' A' ' 275' ' ' GLU . 81.3 t -63.81 -43.3 97.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.803 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . 0.46 ' O ' ' HG2' ' A' ' 287' ' ' ARG . 5.8 t -59.22 -45.72 90.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.156 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -69.63 -43.85 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 290' ' ' HIS . 4.4 p -61.27 -48.6 80.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.932 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 284' ' ' SER . 34.9 ptt180 -65.58 -34.88 79.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 110.467 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.24 -65.1 0.7 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.092 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.486 ' HD3' HD23 ' A' ' 292' ' ' LEU . 25.6 mmtt -63.04 -39.21 94.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.824 -0.75 . . . . 0.0 109.961 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 286' ' ' SER . 39.7 t-80 -43.94 -55.78 4.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.076 0.465 . . . . 0.0 110.051 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.24 79.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.883 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.486 HD23 ' HD3' ' A' ' 289' ' ' LYS . 18.1 tp -59.78 -53.21 60.63 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.838 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.21 -42.26 96.68 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.253 0.549 . . . . 0.0 110.31 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.0 tt0 -61.93 -37.68 85.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.786 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.48 -43.67 97.83 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -59.45 -44.44 92.97 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.356 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.538 HG21 ' OE1' ' A' ' 261' ' ' GLN . 44.8 p -59.17 -44.61 92.16 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.654 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -62.36 -45.32 93.7 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.638 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.79 -38.88 89.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.202 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.26 96.71 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.35 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.69 -42.71 98.04 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -61.3 -44.23 97.56 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.995 0.426 . . . . 0.0 110.573 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . 0.578 HG22 ' ND1' ' A' ' 307' ' ' HIS . 19.8 m -60.44 -43.92 96.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.656 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.83 -43.38 91.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -57.8 -51.78 68.19 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.824 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -63.61 -40.92 98.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.462 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.578 ' ND1' HG22 ' A' ' 303' ' ' THR . 5.8 m80 -63.62 -36.42 83.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.929 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.528 ' CD2' HG21 ' A' ' 223' ' ' VAL . 7.8 mt -62.02 -44.38 96.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.614 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.4 -47.81 69.22 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.943 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.46 -48.14 82.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 311' ' ' LEU . 25.5 mt -63.2 -39.45 94.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.576 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 39.2 t -58.93 -44.42 91.37 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.15 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.63 -41.75 89.1 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 317' ' ' ARG . 94.3 mtt-85 -64.41 -45.13 88.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.917 0.389 . . . . 0.0 111.233 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.9 mm -72.52 -18.03 18.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.712 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 71.8 p -50.49 -34.82 26.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 314' ' ' ARG . 0.3 OUTLIER -143.22 157.65 44.31 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 178.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.429 ' O ' ' O ' ' A' ' 319' ' ' ARG . . . -143.55 100.95 3.69 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 119.959 -0.697 . . . . 0.0 110.71 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' A' ' 318' ' ' ALA . 39.4 mmm-85 -43.74 175.1 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.055 -0.975 . . . . 0.0 112.235 -178.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -59.91 -50.41 73.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.196 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.472 ' O ' ' OE1' ' A' ' 239' ' ' GLU . 70.7 m-80 -94.74 -99.77 0.15 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.153 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -119.57 135.63 54.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.326 -0.455 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.904 -179.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.5 m -60.04 -42.73 95.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 51.9 69.31 0.68 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.042 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -126.04 134.0 51.56 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.496 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 6' ' ' ASN . 30.5 tptt -162.45 60.41 0.22 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.658 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.46 ' O ' ' O ' ' A' ' 5' ' ' LYS . 95.9 m-20 41.06 -165.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.542 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -144.72 146.42 31.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.63 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -68.95 -89.96 0.0 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 123.068 2.512 . . . . 0.0 113.092 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm 50.59 67.51 4.28 Favored Pre-proline 0 C--O 1.234 0.239 0 CA-C-O 120.838 0.351 . . . . 0.0 110.444 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.426 ' O ' ' CB ' ' A' ' 11' ' ' SER . 73.9 Cg_endo -73.79 -16.81 23.33 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 123.199 2.599 . . . . 0.0 113.021 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 10' ' ' PRO . 1.2 p 74.86 149.41 0.12 Allowed Pre-proline 0 C--N 1.33 -0.245 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.16 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.99 150.7 55.18 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.71 2.274 . . . . 0.0 112.15 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -158.79 113.15 2.46 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.498 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -145.99 164.61 31.52 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.142 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -139.91 146.0 38.69 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.172 0.51 . . . . 0.0 111.281 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.3 m -74.67 -87.49 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.172 -178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 79.38 9.23 87.16 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.844 -0.502 . . . . 0.0 111.844 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -68.65 136.36 52.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.648 0.261 . . . . 0.0 110.567 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -130.37 -34.74 1.58 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.902 0.382 . . . . 0.0 110.465 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -98.47 -175.88 3.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.577 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.439 ' HE ' ' HG3' ' A' ' 53' ' ' GLU . 52.5 ptt85 -91.29 -6.4 53.22 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.548 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.408 ' SD ' ' NZ ' ' A' ' 24' ' ' LYS . 3.6 mmt -137.45 144.46 42.33 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.767 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.692 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 46.6 tp10 -66.13 -53.12 41.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.465 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.408 ' NZ ' ' SD ' ' A' ' 22' ' ' MET . 8.0 pttm -51.58 -43.74 62.55 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.239 0.542 . . . . 0.0 110.322 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.2 tp -61.62 -42.95 99.61 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.386 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.723 ' OD1' ' N ' ' A' ' 27' ' ' GLN . 1.5 p-10 -65.25 -25.35 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.234 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.723 ' N ' ' OD1' ' A' ' 26' ' ' ASN . 92.2 mt-30 -69.47 -45.62 68.58 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.921 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.3 mm? -61.83 -41.68 98.09 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.387 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.495 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 41.2 t-105 -61.82 -46.04 91.22 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.342 0.592 . . . . 0.0 110.399 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -57.86 -41.31 82.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.182 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -60.91 -41.76 96.75 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.183 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.93 86.85 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.205 0.526 . . . . 0.0 110.415 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.495 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 75.0 mt-30 -58.29 -39.12 78.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.241 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -62.78 -41.54 99.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.511 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.13 -34.84 77.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.262 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.57 107.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.869 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 37' ' ' LEU . 86.2 mt -129.05 154.54 80.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.572 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 74.8 Cg_exo -41.63 153.32 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.529 2.153 . . . . 0.0 112.206 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.6 Cg_exo -57.2 -47.31 23.14 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.724 2.283 . . . . 0.0 112.327 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 69.5 t -64.29 -47.19 90.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.667 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -63.2 -41.87 99.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.389 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.0 tt -62.3 -43.01 99.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.629 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.5 -41.2 96.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.453 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -69.92 -42.54 73.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.496 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.97 -48.88 78.37 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -61.84 -40.54 95.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.21 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.43 -47.0 87.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.6 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.971 ' O ' HG22 ' A' ' 51' ' ' ILE . 50.3 t0 -59.43 -49.84 76.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.119 0.485 . . . . 0.0 110.293 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.63 -41.4 99.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.1 0.476 . . . . 0.0 110.441 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.26 -47.45 85.95 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.35 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.971 HG22 ' O ' ' A' ' 48' ' ' ASP . 16.9 tt -59.51 -36.82 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.403 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 52.2 tt0 -60.96 -42.42 98.26 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.439 ' HG3' ' HE ' ' A' ' 21' ' ' ARG . 76.7 tt0 -61.07 -40.29 93.09 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.85 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -62.92 -44.29 96.48 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.728 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -60.98 -41.28 96.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.485 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -57.78 -48.49 79.54 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.005 0.431 . . . . 0.0 110.186 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 44.3 tp -59.99 -41.43 92.02 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.11 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.13 93.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.299 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 77.6 t90 -58.34 -44.97 88.95 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.067 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.58 -46.22 91.04 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.54 -41.87 86.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.181 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.12 -40.04 96.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.962 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.72 -42.98 84.91 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 39.4 mt -62.89 -40.29 97.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.103 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -64.33 -36.22 83.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.144 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.36 54.59 1.44 Allowed Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.194 -0.762 . . . . 0.0 111.194 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 67' ' ' LEU . 75.3 mt -119.53 -56.35 2.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.757 0.313 . . . . 0.0 110.598 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -71.39 136.8 47.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.296 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -154.95 -29.38 0.11 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.572 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -64.64 -35.61 81.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.526 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.78 -1.65 81.29 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -58.95 -36.18 74.37 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.359 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 73' ' ' LYS . 13.6 mptt -56.65 -68.58 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.099 0.476 . . . . 0.0 109.958 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -46.04 -38.95 8.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.16 94.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.559 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -63.64 -38.96 93.09 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.448 HD12 ' N ' ' A' ' 77' ' ' LEU . 9.3 mp -64.32 -45.07 89.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.11 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.07 -45.91 95.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.177 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.741 ' O ' HG23 ' A' ' 83' ' ' VAL . 77.2 ttt-85 -59.57 -43.85 93.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.112 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -62.63 -39.74 94.78 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.112 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.666 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.22 -50.92 71.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.285 0.564 . . . . 0.0 110.239 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.409 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 30.0 t-20 -64.97 -37.32 87.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.699 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 79' ' ' ARG . 73.2 t -63.27 -45.88 97.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.393 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.16 -49.98 82.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.507 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.449 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 3.6 mm? -66.55 -42.02 87.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.019 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.24 94.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.06 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -62.38 -47.9 82.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.855 -179.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.08 -26.6 68.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.265 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.19 8.12 78.95 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.969 -0.853 . . . . 0.0 110.969 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 90' ' ' LEU . 56.5 mt -76.05 -18.52 59.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.827 0.346 . . . . 0.0 110.557 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.42 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 23.6 p-10 -65.14 -35.26 80.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.968 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -157.36 179.83 32.82 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.4 mttp -132.14 150.63 52.11 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.897 0.379 . . . . 0.0 110.347 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -130.27 76.41 1.72 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.527 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -89.92 165.36 14.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.29 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -132.53 -178.05 4.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.409 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -66.0 135.81 55.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.609 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -159.78 80.21 0.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.587 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 67.8 t -123.56 129.99 74.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.994 0.426 . . . . 0.0 110.58 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.3 m 45.09 92.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.912 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.8 t -136.99 143.41 42.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.437 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.402 ' OD1' ' O ' ' A' ' 102' ' ' ASN . 41.7 p-10 -120.49 120.97 37.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.52 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 87.9 p -62.24 -36.32 81.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.372 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.7 tp -84.03 149.97 25.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.587 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.2 p 62.28 163.38 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.357 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.13 88.92 0.07 OUTLIER Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.656 -0.977 . . . . 0.0 110.656 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.8 t -140.44 161.63 37.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.861 0.362 . . . . 0.0 110.451 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -139.74 148.05 41.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.524 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -177.4 45.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.553 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -119.06 21.78 12.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.639 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.13 -113.44 1.54 Allowed Glycine 0 N--CA 1.462 0.419 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.5 tp -142.31 1.05 1.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.751 0.31 . . . . 0.0 110.76 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.54 ' N ' ' OE2' ' A' ' 118' ' ' GLU . 50.9 t0 61.15 24.04 14.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.72 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 113' ' ' ASP . 37.7 m-20 -139.23 102.0 7.48 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.505 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -50.5 -40.97 53.96 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.566 2.177 . . . . 0.0 112.297 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -62.68 -42.26 99.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.921 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.0 mt -85.79 -36.28 20.19 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.629 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 94.7 mt-10 -62.4 -28.69 69.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.505 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 11.2 mmmt -60.96 -46.62 90.0 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.574 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 120' ' ' LEU . 81.3 mt -69.35 -46.79 66.17 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 120.948 0.404 . . . . 0.0 111.796 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.45 ' CE3' HD22 ' A' ' 135' ' ' LEU . 11.9 t-105 -59.25 -47.08 86.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.605 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.629 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.1 m-70 -69.73 -34.22 73.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.615 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.541 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 10.6 tptt -57.92 -52.0 67.32 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.178 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.818 ' O ' ' O ' ' A' ' 128' ' ' GLY . . . -73.61 -46.7 45.44 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.236 -0.586 . . . . 0.0 110.523 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.573 ' HB2' HD11 ' A' ' 135' ' ' LEU . 64.3 tttm -50.09 -39.79 43.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.669 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.463 ' C ' ' H ' ' A' ' 128' ' ' GLY . 20.8 m -97.69 -66.67 0.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.708 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 m -55.74 -7.0 0.24 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.419 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 1.153 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -160.25 98.38 0.17 Allowed Glycine 0 C--O 1.226 -0.373 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -41.98 44.78 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.355 0.598 . . . . 0.0 109.928 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 1.153 ' N ' ' O ' ' A' ' 128' ' ' GLY . 3.4 m-30 -81.05 32.09 0.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.385 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.647 ' HA ' HD12 ' A' ' 135' ' ' LEU . 6.2 m -85.13 128.45 34.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.008 0.432 . . . . 0.0 111.533 -179.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.45 ' O ' ' CG ' ' A' ' 136' ' ' ASP . . . 111.3 -98.17 1.01 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.356 177.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 74.7 mm-40 -79.17 -43.85 23.11 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.991 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.463 ' O ' HD23 ' A' ' 138' ' ' LEU . 57.1 mp0 -62.44 -50.49 71.28 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.076 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.647 HD12 ' HA ' ' A' ' 131' ' ' SER . 2.7 mt -61.09 -42.09 97.87 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.363 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.45 ' CG ' ' O ' ' A' ' 132' ' ' GLY . 96.2 m-20 -63.3 -37.71 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.936 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 23.1 mmtp -62.26 -44.25 96.97 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-O 121.266 0.555 . . . . 0.0 109.991 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.2 mm? -60.21 -43.47 95.93 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.247 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.481 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -65.21 -36.64 84.79 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.058 176.459 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.607 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 86.5 mtt180 -53.53 -43.79 68.66 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -70.12 -38.37 75.56 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.76 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.481 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.1 m-85 -59.35 -58.54 8.16 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.59 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 67.0 mt -60.79 -38.84 86.7 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.022 -0.671 . . . . 0.0 110.26 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.607 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 61.3 m170 -53.15 -43.98 67.45 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.096 -0.642 . . . . 0.0 109.706 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.461 ' ND1' HG23 ' A' ' 197' ' ' ILE . 3.3 m-70 -64.09 -39.52 94.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.658 178.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -61.75 -44.46 96.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.33 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -68.26 -51.2 47.79 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.698 0.285 . . . . 0.0 111.516 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -61.58 -43.42 98.9 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.954 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 26.1 t -62.49 -43.36 98.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.021 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.771 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -63.21 -38.51 91.45 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.67 -47.68 84.26 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.279 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.46 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 23.0 m-85 -65.8 -46.62 77.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.551 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.82 79.89 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.504 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.771 HG23 ' O ' ' A' ' 150' ' ' HIS . 77.9 t -63.31 -45.48 98.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.031 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.2 mt -64.04 -42.21 97.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.519 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.421 HD21 HD21 ' A' ' 190' ' ' LEU . 20.2 mt -62.68 -45.26 93.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.641 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -67.83 -27.3 66.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.058 0.456 . . . . 0.0 110.229 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 65.4 m -67.83 -50.75 55.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.912 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.49 ' O ' ' OG1' ' A' ' 162' ' ' THR . 1.3 pp -79.46 -20.86 46.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.699 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 43.9 m -60.86 -38.12 84.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.672 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.558 ' C ' ' H ' ' A' ' 163' ' ' GLU . 76.3 mtp180 -63.28 -38.43 91.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.795 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 159' ' ' LEU . 11.8 p -67.53 35.86 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.671 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.558 ' H ' ' C ' ' A' ' 161' ' ' ARG . 86.0 tt0 -134.85 -40.52 0.77 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.09 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -100.66 28.82 4.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.251 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.706 HG23 ' O ' ' A' ' 165' ' ' ILE . 20.1 tt -55.73 110.13 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.908 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 45.5 m170 50.98 21.56 1.01 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.986 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 41.76 92.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.751 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.603 HD22 ' C ' ' A' ' 168' ' ' ASN . 0.3 OUTLIER -160.48 175.16 13.07 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.402 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 14.1 t 62.76 109.77 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.47 ' O ' HG23 ' A' ' 170' ' ' ILE . 10.3 tp -143.73 129.55 15.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.583 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.06 160.22 43.8 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.435 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -77.5 93.18 1.09 Allowed 'Trans proline' 0 C--N 1.307 -1.636 0 C-N-CA 122.757 2.305 . . . . 0.0 112.176 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 19.5 t -153.84 142.23 20.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.644 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -61.99 -45.11 95.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.417 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.69 ' N ' HD23 ' A' ' 175' ' ' LEU . 2.5 pt? -155.55 144.88 20.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.377 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.4 ' HB2' ' CD1' ' A' ' 183' ' ' LEU . 23.0 t 46.29 -85.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.524 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 175' ' ' LEU . 5.1 p30 -173.84 24.44 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.737 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.691 ' O ' HD12 ' A' ' 178' ' ' ILE . 1.0 OUTLIER -134.76 160.01 41.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.999 179.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -66.63 -38.82 87.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.376 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 161.43 14.01 0.03 OUTLIER Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 6.0 t -64.88 -23.64 67.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.789 0.328 . . . . 0.0 110.671 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.845 HG12 ' H ' ' A' ' 183' ' ' LEU . 22.9 t -137.08 178.97 4.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.676 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.845 ' H ' HG12 ' A' ' 182' ' ' VAL . 2.9 mt 65.68 -16.23 0.11 Allowed 'General case' 0 C--O 1.239 0.515 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.614 ' ND1' ' N ' ' A' ' 185' ' ' SER . 30.9 p80 -57.81 -42.72 84.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.557 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.614 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 90.0 p -62.24 -43.07 99.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.045 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.787 ' HE ' HD23 ' A' ' 183' ' ' LEU . 56.2 mtm-85 -60.62 -41.07 94.09 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.83 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -66.57 -41.2 88.93 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.172 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 55.6 m -62.84 -44.55 95.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.232 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -61.69 -40.62 95.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.141 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.626 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 7.1 mt -62.47 -43.35 99.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.866 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.6 mttm -70.67 -32.72 70.08 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.602 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.4 tt0 -68.42 -45.89 71.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.183 -178.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.626 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 7.8 ptmt -73.47 -44.61 57.62 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.498 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.78 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -65.18 -41.72 94.34 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.887 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.529 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -68.32 -36.58 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.819 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.412 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 63.8 m -61.45 -40.93 96.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.461 HG23 ' ND1' ' A' ' 145' ' ' HIS . 96.6 mt -63.53 -43.95 98.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.518 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.8 -42.25 97.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -63.97 -37.39 87.24 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.568 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.98 -43.15 99.79 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 17.5 mt -64.06 -42.26 97.06 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.201 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.69 -38.38 90.19 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.778 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.665 ' O ' HG12 ' A' ' 207' ' ' VAL . 31.7 mt -61.0 -39.01 88.07 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.413 179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 83.3 mtt-85 -64.12 -41.62 97.16 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.19 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.6 mtp180 -64.82 -42.85 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.769 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.665 HG12 ' O ' ' A' ' 204' ' ' LEU . 0.3 OUTLIER -63.77 -37.42 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.44 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.417 ' N ' ' CG1' ' A' ' 207' ' ' VAL . 25.4 m -75.96 -26.92 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.575 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -98.29 -15.08 19.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.033 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.526 ' N ' ' O ' ' A' ' 206' ' ' ARG . 52.4 mt-30 -129.53 -39.07 1.5 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.696 -179.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -70.14 46.33 0.62 Allowed Glycine 0 CA--C 1.523 0.549 0 N-CA-C 111.392 -0.683 . . . . 0.0 111.392 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.482 ' CG ' ' N ' ' A' ' 213' ' ' SER . 20.5 t80 -89.49 -138.79 0.13 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.856 0.36 . . . . 0.0 110.333 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.772 ' O ' ' O ' ' A' ' 214' ' ' THR . 54.4 p -146.37 -62.56 0.31 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.917 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.772 ' O ' ' O ' ' A' ' 213' ' ' SER . 8.9 t 43.97 155.74 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.627 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -173.53 157.11 3.15 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.224 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -87.13 178.44 6.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.502 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.537 ' OE1' ' N ' ' A' ' 217' ' ' GLU . 56.1 mp0 -143.7 -11.77 0.68 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 110.017 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.559 ' CD2' HG21 ' A' ' 224' ' ' ILE . 42.2 m-85 -55.09 177.54 0.04 OUTLIER 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.504 179.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -51.43 -54.54 25.8 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -145.18 154.5 54.14 Favored Pre-proline 0 C--N 1.326 -0.431 0 C-N-CA 119.165 -1.014 . . . . 0.0 110.479 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.73 13.99 0.88 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.663 2.242 . . . . 0.0 112.147 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -124.58 -40.98 2.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.02 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 1.068 HG13 ' H ' ' A' ' 224' ' ' ILE . 5.8 p -61.47 -78.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.246 0.916 0 CA-C-O 121.42 0.629 . . . . 0.0 110.869 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 1.068 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.1 mp -58.05 -25.54 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.45 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -63.24 -46.91 84.71 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.205 0.526 . . . . 0.0 109.844 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.457 HD23 HD12 ' A' ' 229' ' ' LEU . 24.5 mt -61.48 -40.99 96.53 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.677 179.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.0 m0 -61.39 -35.58 77.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.953 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -64.86 -37.28 87.1 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.708 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.6 mt -63.41 -41.27 98.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.968 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -60.03 20.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.0 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.708 ' H ' ' C ' ' A' ' 229' ' ' LEU . 13.8 tt0 -94.26 -44.82 7.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.668 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 69.2 p -121.03 -0.69 9.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.622 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.33 -103.52 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.587 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -141.53 95.39 2.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.505 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 3.8 mp -137.84 160.26 39.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.95 0.405 . . . . 0.0 110.562 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 33.9 p -85.44 -157.41 0.32 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.586 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . 0.47 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 27.4 p-10 -96.34 -59.33 1.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.629 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . 0.47 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 54.4 mtmt -62.25 -44.03 97.48 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 110.697 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -60.33 -32.0 70.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.163 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.632 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.2 OUTLIER -63.94 -43.24 96.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.189 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -63.73 -49.5 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.16 -38.23 85.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.042 0.449 . . . . 0.0 110.092 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.578 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.3 OUTLIER -68.21 -41.74 80.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.01 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -58.6 -52.25 66.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.96 0.41 . . . . 0.0 110.197 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.7 -42.27 95.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.577 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -56.5 -48.12 77.86 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.416 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 243' ' ' PHE . 1.4 mm? -63.49 -38.38 90.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.484 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.797 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 78.7 tttt -56.56 -44.81 81.29 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.347 0.594 . . . . 0.0 110.296 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -67.62 -38.57 84.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.488 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.35 -49.24 78.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.797 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.1 OUTLIER -60.5 -39.89 89.4 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.237 0.542 . . . . 0.0 109.873 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . 0.521 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.08 -36.86 84.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.266 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -62.37 -49.88 73.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.144 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.485 HG22 ' O ' ' A' ' 251' ' ' GLU . 11.9 tt -61.91 -36.0 71.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.362 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -62.98 -45.9 90.26 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.166 0.508 . . . . 0.0 110.349 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -63.16 -44.77 94.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.536 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . 0.793 ' HB2' HD23 ' A' ' 300' ' ' LEU . 2.3 t-80 -55.96 -43.49 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.163 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -62.07 -40.97 97.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.19 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . 0.519 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 80.2 t60 -58.76 -48.21 82.02 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.413 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -63.52 -33.44 75.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.544 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.503 HE21 ' HB ' ' A' ' 297' ' ' THR . 64.3 mm-40 -61.63 -47.71 84.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.214 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -61.43 -46.25 90.87 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.051 0.453 . . . . 0.0 110.061 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . 0.519 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.6 mp0 -64.7 -35.18 80.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.242 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.82 -42.59 99.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.06 -46.24 85.23 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.467 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.64 -43.37 98.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.346 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -63.26 -36.89 85.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.252 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -61.64 -47.73 84.05 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.332 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -64.54 -43.52 93.7 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.628 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.49 -43.09 99.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.518 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 271' ' ' LEU . 6.1 tt -60.85 -44.38 97.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.322 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.97 -43.9 91.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.281 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -69.07 -47.32 65.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.663 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.841 ' O ' HG22 ' A' ' 277' ' ' VAL . . . -60.43 -24.63 65.34 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.492 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -84.46 -1.74 56.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.476 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 42.2 m -120.06 -3.14 10.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.707 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.841 HG22 ' O ' ' A' ' 274' ' ' ALA . 16.8 m -63.33 -42.66 97.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.499 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.448 ' N ' HG23 ' A' ' 277' ' ' VAL . . . 139.03 -82.9 0.25 Allowed Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -62.88 139.06 58.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.757 0.313 . . . . 0.0 110.402 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -107.41 116.44 4.92 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -145.49 -45.12 0.21 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.488 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -98.7 0.64 45.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.553 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.97 -48.29 88.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.538 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.5 t -63.36 -46.84 84.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.907 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.6 -41.65 96.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.739 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.0 t -62.47 -44.07 97.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -63.43 -41.61 98.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.498 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -60.34 -52.33 65.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.278 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.534 ' HD3' HD23 ' A' ' 292' ' ' LEU . 18.2 mmtm -65.77 -33.42 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.135 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -56.45 -48.05 77.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.155 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.22 -40.44 71.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.968 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.591 ' O ' HD12 ' A' ' 292' ' ' LEU . 3.5 tp -61.81 -50.67 71.39 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.26 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 23.9 tp -63.63 -41.48 98.25 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.49 ' O ' ' OG1' ' A' ' 297' ' ' THR . 76.4 tt0 -62.73 -37.72 87.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.022 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . 0.463 ' O ' ' HG3' ' A' ' 299' ' ' GLU . . . -64.01 -47.03 89.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . 0.461 HH12 HD22 ' A' ' 300' ' ' LEU . 15.4 tpt85 -57.82 -44.16 86.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.474 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.503 ' HB ' HE21 ' A' ' 261' ' ' GLN . 12.2 p -60.36 -48.1 83.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.346 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 295' ' ' GLY . 90.3 mt-10 -57.95 -55.33 36.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.592 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . 0.793 HD23 ' HB2' ' A' ' 257' ' ' HIS . 12.9 tp -61.56 -45.03 95.87 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.465 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -47.43 -47.02 22.88 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.084 -1.206 . . . . 0.0 110.084 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -65.48 -37.15 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.929 0.395 . . . . 0.0 109.967 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 20.0 m -60.47 -47.4 86.29 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . 0.401 HG13 HD13 ' A' ' 308' ' ' LEU . 1.3 t -61.36 -46.13 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.376 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -61.41 -46.78 88.69 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.044 0.449 . . . . 0.0 110.284 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -58.56 -50.18 74.72 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.424 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.55 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.4 OUTLIER -65.07 -30.34 71.29 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.99 178.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.782 HD11 HG21 ' A' ' 223' ' ' VAL . 1.4 tp -58.53 -46.58 86.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.056 -178.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -76.15 -54.49 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.813 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 310' ' ' ASP . 61.6 t0 -58.96 -52.23 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.55 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 3.4 tp -61.67 -39.79 92.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.512 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 10.4 t -58.73 -43.56 90.2 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.665 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.17 -40.12 94.8 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 317' ' ' ARG . 77.5 mtp180 -61.7 -43.46 98.82 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-O 120.693 0.282 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.7 -42.48 95.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.792 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 83.6 p -49.67 -39.77 37.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.224 0.535 . . . . 0.0 109.649 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.66 ' O ' ' O ' ' A' ' 314' ' ' ARG . 22.4 tpp85 -117.98 122.82 44.2 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.643 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -131.68 99.42 4.78 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.289 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -100.23 -167.8 1.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.736 -178.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 79.3 m80 -70.0 -168.86 0.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.81 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 58.77 42.36 20.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.511 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 50.31 25.06 1.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.661 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.542 HD23 ' C ' ' A' ' 323' ' ' LEU . 5.0 tt . . . . . 0 C--O 1.219 -0.502 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.378 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.8 p -88.54 -2.92 58.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.722 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 38.2 ptt-85 -62.89 137.04 58.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.726 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -170.58 116.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.536 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -165.02 99.66 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -161.51 171.25 18.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.688 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 54.84 92.6 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.378 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.61 142.91 95.8 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.398 2.065 . . . . 0.0 112.003 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 2.8 tmtm? -97.48 -42.65 0.25 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.62 ' CD ' ' N ' ' A' ' 9' ' ' LYS . 31.2 Cg_exo -61.57 146.62 96.77 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.751 2.301 . . . . 0.0 112.466 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.601 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER 171.33 -42.2 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.666 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 11' ' ' SER . 17.1 Cg_exo -64.28 151.5 85.19 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 C-N-CA 122.614 2.209 . . . . 0.0 111.913 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -66.51 153.11 43.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.378 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.7 ptm180 -63.01 137.25 58.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.598 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -137.43 151.18 48.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.2 p -138.87 152.72 48.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.568 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.38 178.51 25.39 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -166.68 121.33 1.1 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.858 0.361 . . . . 0.0 110.635 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -68.23 -34.78 76.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.651 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -124.57 167.26 14.72 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.787 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -88.68 2.39 53.37 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.723 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.436 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 3.7 mmt -143.11 140.06 30.71 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.375 0.607 . . . . 0.0 110.824 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -62.22 -36.26 81.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.306 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -56.5 -47.08 80.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.131 0.491 . . . . 0.0 110.542 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 25' ' ' LEU . 99.3 mt -61.47 -40.17 93.55 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.856 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.436 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.5 m-80 -63.94 -37.4 87.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.169 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -60.39 -48.66 80.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.297 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.429 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 4.0 mm? -61.23 -42.38 98.5 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.205 179.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.509 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 34.1 t-105 -62.18 -44.53 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.229 0.538 . . . . 0.0 110.387 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -57.03 -44.96 83.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.246 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.6 -42.82 97.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.424 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.27 -41.85 80.5 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.218 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.509 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.2 mt-30 -64.7 -37.67 88.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.192 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -60.09 -43.62 95.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.449 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.39 -39.46 92.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.596 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.45 110.72 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.849 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.47 HD22 ' HE ' ' A' ' 41' ' ' ARG . 13.8 mt -131.46 154.16 81.81 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.62 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -43.28 154.32 0.18 Allowed 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.618 2.212 . . . . 0.0 112.193 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.51 -42.04 69.74 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.582 2.188 . . . . 0.0 112.191 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.15 -49.71 82.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.551 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.47 ' HE ' HD22 ' A' ' 37' ' ' LEU . 78.6 mtp85 -66.47 -41.35 89.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 tp -64.26 -40.18 95.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.434 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 41' ' ' ARG . 18.1 pt-20 -65.15 -38.86 91.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.466 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.37 -50.11 72.85 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.398 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -61.2 -39.97 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.444 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.94 92.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.425 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -60.56 -50.17 74.61 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.366 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.04 -39.3 94.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.383 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -56.55 -46.91 80.43 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.215 0.531 . . . . 0.0 110.142 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.7 mt -62.31 -42.73 96.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.761 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -51.51 -42.81 61.98 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -64.42 -41.26 96.7 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -61.4 -44.45 97.13 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.629 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -61.22 -41.62 97.17 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.373 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -54.75 -46.74 74.37 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.149 0.499 . . . . 0.0 110.062 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 23.8 mt -61.72 -41.4 97.57 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.334 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.94 -46.33 88.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.647 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.5 t90 -58.99 -39.9 83.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.342 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -59.89 -46.06 90.53 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.08 -41.51 92.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.114 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.5 mt -61.36 -40.5 94.51 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.956 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.37 -43.3 96.69 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 51.5 tp -59.65 -42.64 93.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.889 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -67.23 -35.53 79.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.253 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 94.55 26.62 13.04 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 81.8 mt -81.07 -42.37 21.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.834 0.349 . . . . 0.0 110.906 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.424 ' OD1' ' O ' ' A' ' 68' ' ' ASP . 54.4 p-10 -67.49 147.72 52.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.377 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -161.82 -51.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.596 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.59 -29.37 69.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.473 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 85.46 9.71 78.52 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -56.94 -36.63 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.863 0.363 . . . . 0.0 110.32 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -58.86 -64.78 0.81 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.853 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -44.87 -42.73 8.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.209 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.11 84.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.214 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -62.04 -41.58 98.27 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.495 HD12 ' N ' ' A' ' 77' ' ' LEU . 10.7 mp -62.86 -43.65 98.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.957 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.36 -47.72 90.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.106 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.681 ' O ' HG23 ' A' ' 83' ' ' VAL . 93.7 mtt-85 -59.51 -43.35 93.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.924 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.501 ' O ' HG13 ' A' ' 84' ' ' ILE . 93.2 m-20 -64.33 -41.26 96.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.389 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.3 -48.33 71.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.008 0.432 . . . . 0.0 110.253 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -66.77 -36.48 82.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.366 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 79' ' ' ARG . 75.1 t -63.85 -47.95 88.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.539 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 80' ' ' ASN . 48.6 mt -61.26 -50.34 80.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.631 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.22 -41.79 94.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.918 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.68 80.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.72 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.29 -44.77 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.844 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -59.47 -34.27 72.35 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.098 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 88.79 17.76 55.86 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.888 ' O ' ' N ' ' A' ' 92' ' ' GLY . 5.4 mt -83.29 -83.32 0.14 Allowed 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.472 ' CG ' ' H ' ' A' ' 92' ' ' GLY . 3.1 p-10 43.7 -65.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.951 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.888 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . 139.78 -175.66 21.66 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -93.8 5.08 52.83 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.632 0.253 . . . . 0.0 110.636 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt 64.04 41.58 6.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.77 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 46.7 p-10 -147.35 137.88 23.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.676 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -169.47 -64.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.657 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 55.39 80.91 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.457 ' O ' ' OE1' ' A' ' 98' ' ' GLN . 4.0 pp0? -175.47 25.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.736 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 85.5 t -63.89 -44.26 97.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.435 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 42.8 p -65.75 -18.42 65.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.317 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.6 m -59.5 -40.9 88.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.53 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -107.77 -177.65 3.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.571 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.584 ' O ' ' O ' ' A' ' 104' ' ' LEU . 52.1 m 56.15 50.59 13.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.432 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.584 ' O ' ' O ' ' A' ' 103' ' ' SER . 10.8 mp 51.09 155.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.691 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 17.3 m -78.66 146.35 34.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.251 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -161.85 68.76 0.23 Allowed Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 41.1 m -72.18 127.52 32.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.796 0.331 . . . . 0.0 110.244 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.508 ' O ' ' NE2' ' A' ' 108' ' ' GLN . 4.3 pp0? -167.94 148.49 5.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.556 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -160.89 20.7 0.13 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -98.67 111.38 23.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.969 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.3 124.61 4.63 Favored Glycine 0 CA--C 1.521 0.439 0 N-CA-C 111.254 -0.738 . . . . 0.0 111.254 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.554 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 19.7 mt -58.82 146.29 37.73 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.664 0.269 . . . . 0.0 110.366 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -90.16 -5.18 56.73 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.551 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -79.97 124.69 82.96 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.43 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.414 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 37.6 Cg_endo -65.76 -34.38 40.59 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.378 2.052 . . . . 0.0 112.625 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 48.7 mmm-85 -68.12 -45.82 72.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.093 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 46.8 mt -74.24 -33.75 63.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.616 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.554 ' OE2' ' O ' ' A' ' 112' ' ' LEU . 68.0 mt-10 -58.5 -33.35 69.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.811 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.76 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 52.7 mtpt -61.09 -48.35 82.11 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.901 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.575 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 13.5 mt -70.57 -46.83 62.75 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.966 0.412 . . . . 0.0 111.939 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.673 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.8 t-105 -59.38 -49.54 77.42 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.456 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.542 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.0 m-70 -71.16 -32.85 69.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.661 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.76 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 11.6 tptt -55.43 -51.65 66.19 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.949 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.09 -46.79 49.42 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.885 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.412 ' HB2' HD11 ' A' ' 135' ' ' LEU . 58.4 tttm -50.97 -48.75 61.03 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.969 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 12.4 m -83.91 -41.15 17.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.872 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.597 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 8.8 t -46.48 -26.1 0.8 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.296 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -159.09 -94.51 0.1 Allowed Glycine 0 N--CA 1.464 0.536 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.363 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.548 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.2 pttp -161.52 24.08 0.12 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.96 44.74 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.318 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.1 p -103.44 136.42 43.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.083 0.468 . . . . 0.0 111.288 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 97.89 -97.1 1.89 Allowed Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.173 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 94.7 mt-10 -75.11 -43.81 50.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.806 0.336 . . . . 0.0 111.116 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.62 ' O ' HD23 ' A' ' 138' ' ' LEU . 53.3 mp0 -61.82 -54.38 43.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.673 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.8 mt -59.63 -40.51 87.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.323 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -60.77 -44.11 97.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 61.3 mttp -60.55 -44.17 96.42 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.665 HD13 ' OE2' ' A' ' 141' ' ' GLU . 4.5 mm? -57.79 -39.11 76.76 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.607 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.5 OUTLIER -73.28 -29.43 62.73 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.344 -0.843 . . . . 0.0 113.08 177.174 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.512 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 95.3 mtt-85 -57.38 -46.49 83.36 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.097 -1.041 . . . . 0.0 108.243 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.665 ' OE2' HD13 ' A' ' 138' ' ' LEU . 6.1 pt-20 -72.71 -37.65 67.73 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.733 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.607 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 1.9 m-85 -55.75 -57.26 12.76 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.393 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.787 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 48.6 mt -61.75 -39.22 90.84 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.043 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.512 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 63.4 m170 -54.54 -41.02 69.25 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.758 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -65.28 -45.88 82.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.193 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.787 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 45.4 pttt -59.65 -44.43 93.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.175 -178.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.545 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 74.1 mm-40 -68.24 -48.88 63.94 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.542 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -60.99 -44.21 97.74 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.856 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.84 -45.36 99.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.112 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.702 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.3 m170 -64.59 -34.29 77.91 Favored 'General case' 0 C--O 1.216 -0.699 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.362 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -64.65 -48.04 76.27 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.229 -0.589 . . . . 0.0 110.502 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.424 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 37.2 m-85 -63.95 -46.37 85.01 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.566 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -69.1 -45.18 70.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.837 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 150' ' ' HIS . 71.2 t -64.79 -43.73 96.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.342 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 37.6 mt -62.7 -50.53 70.76 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.373 -179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.77 HD12 ' C ' ' A' ' 156' ' ' LEU . 0.3 OUTLIER -66.18 -40.67 90.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.723 -179.358 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.576 ' N ' ' HG ' ' A' ' 156' ' ' LEU . 74.2 mm-40 -70.8 -30.02 66.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.038 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . 0.597 ' O ' ' OG1' ' A' ' 162' ' ' THR . 6.1 m -64.99 -51.01 64.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.73 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 160' ' ' SER . 2.3 pp -73.83 -37.72 64.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.662 ' N ' HD12 ' A' ' 159' ' ' LEU . 50.5 m -63.73 -43.71 95.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.255 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.471 ' CG ' ' N ' ' A' ' 162' ' ' THR . 8.9 ptm180 -73.16 -41.19 64.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.155 -179.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.63 ' C ' ' H ' ' A' ' 164' ' ' GLU . 14.6 p -80.04 164.6 23.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.722 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 59.24 -5.29 0.07 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.374 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.63 ' H ' ' C ' ' A' ' 162' ' ' THR . 93.0 mt-10 -146.38 24.98 1.24 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.354 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.525 ' O ' ' CG ' ' A' ' 166' ' ' HIS . 3.6 tp -55.88 132.82 19.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.378 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.525 ' CG ' ' O ' ' A' ' 165' ' ' ILE . 73.5 m80 -160.46 46.48 0.23 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.099 0.476 . . . . 0.0 109.779 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -51.11 85.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.881 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.523 ' N ' ' O ' ' A' ' 166' ' ' HIS . 89.9 m-20 -141.5 -164.9 1.87 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.47 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 18.4 m -65.99 134.06 30.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.941 0.401 . . . . 0.0 110.476 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 16.3 tt -69.65 153.92 8.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.519 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . 0.564 ' O ' ' N ' ' A' ' 173' ' ' SER . 5.6 p -129.22 86.04 57.85 Favored Pre-proline 0 N--CA 1.456 -0.149 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.321 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -38.74 83.95 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 122.806 2.337 . . . . 0.0 112.146 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.564 ' N ' ' O ' ' A' ' 171' ' ' SER . 0.1 OUTLIER -108.09 116.13 31.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.632 -179.667 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -62.65 -45.64 91.9 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.329 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.512 ' O ' ' N ' ' A' ' 177' ' ' ASP . 2.6 mt -147.27 24.26 1.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.5 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.515 ' O ' ' OD1' ' A' ' 177' ' ' ASP . 4.3 m 43.93 17.79 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.451 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.515 ' OD1' ' O ' ' A' ' 176' ' ' SER . 3.8 p-10 45.0 44.81 8.43 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.624 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.643 HG22 ' H ' ' A' ' 181' ' ' SER . 2.7 mt -72.65 127.88 35.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.371 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -63.97 -42.06 97.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.593 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -90.05 -47.03 3.99 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.643 ' H ' HG22 ' A' ' 178' ' ' ILE . 1.2 m 58.01 20.52 6.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.606 0.241 . . . . 0.0 110.465 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.583 HG12 ' O ' ' A' ' 182' ' ' VAL . 50.2 t -54.13 -0.88 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.827 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 181' ' ' SER . 28.4 mt -80.49 -6.76 58.66 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.967 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.57 ' CD2' ' O ' ' A' ' 181' ' ' SER . 5.4 p80 -60.22 -37.4 80.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.377 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.548 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 72.5 m -61.85 -45.43 93.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.098 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.613 ' O ' HD13 ' A' ' 190' ' ' LEU . 77.6 mtp85 -63.81 -44.74 92.37 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.859 -0.337 . . . . 0.0 110.795 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -62.92 -38.68 91.97 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.984 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 58.8 m -61.27 -45.77 93.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.983 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -58.06 -42.76 86.19 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.7 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 186' ' ' ARG . 8.8 mp -61.78 -38.55 88.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.225 178.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 195' ' ' ARG . 97.9 mttt -67.67 -32.48 73.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.388 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 97.3 mt-10 -67.85 -50.12 58.33 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.023 0.44 . . . . 0.0 111.386 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.469 ' O ' ' OG ' ' A' ' 196' ' ' SER . 2.1 ptmt -71.55 -41.76 68.71 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.373 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.778 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.29 -41.72 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.841 -179.361 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.559 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 14.6 ptm180 -63.46 -39.13 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.7 -41.72 97.98 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 193' ' ' LYS . 85.2 mt -64.2 -43.32 97.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.561 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.475 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.5 m-20 -62.59 -40.86 98.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.247 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.524 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 1.3 mp0 -60.55 -39.17 86.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -62.94 -37.96 95.79 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 201' ' ' LEU . 21.6 mt -63.19 -41.12 99.15 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.717 178.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.543 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.5 OUTLIER -64.2 -35.97 82.55 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.482 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 4.5 tmt_? -64.25 -41.15 97.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.915 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.9 mt -61.58 -40.25 94.07 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -61.69 -42.86 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.897 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.577 ' O ' ' HG2' ' A' ' 210' ' ' GLN . 73.5 mtp85 -62.7 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.676 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.4 OUTLIER -62.55 -36.6 75.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 75.4 p -77.37 -26.08 51.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.094 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -95.05 -12.98 25.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.884 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.577 ' HG2' ' O ' ' A' ' 206' ' ' ARG . 0.8 OUTLIER -131.82 -37.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.303 -179.136 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.629 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -78.57 31.72 1.9 Allowed Glycine 0 CA--C 1.527 0.825 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.445 ' H ' ' C ' ' A' ' 210' ' ' GLN . 1.6 m-85 -59.17 -38.01 78.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.676 0.274 . . . . 0.0 111.289 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.453 ' O ' ' O ' ' A' ' 214' ' ' THR . 92.5 p -137.27 101.55 4.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.035 0.445 . . . . 0.0 110.359 -179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.844 HG22 ' H ' ' A' ' 215' ' ' GLU . 7.5 m 48.5 178.62 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.511 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.844 ' H ' HG22 ' A' ' 214' ' ' THR . 73.3 mm-40 -96.3 -42.2 8.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.379 -178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -102.58 128.38 49.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.547 -178.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.667 ' OE2' ' CD ' ' A' ' 220' ' ' GLU . 1.1 mm-40 -163.08 33.02 0.1 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.069 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -103.38 10.88 37.19 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.502 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -140.36 -25.58 0.78 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.237 -179.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.667 ' CD ' ' OE2' ' A' ' 217' ' ' GLU . 10.3 mt-10 -45.91 161.54 0.26 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.88 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -71.29 111.13 3.02 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.527 2.151 . . . . 0.0 112.45 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -170.32 -84.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.845 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.618 HG23 ' N ' ' A' ' 224' ' ' ILE . 2.7 m -61.87 -49.74 83.01 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 CA-C-O 121.506 0.67 . . . . 0.0 110.575 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.618 ' N ' HG23 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -67.25 -26.51 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -66.99 -42.48 84.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.417 0.627 . . . . 0.0 109.318 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.0 tp -61.08 -42.05 97.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.171 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.449 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 48.2 m0 -60.62 -37.76 82.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.848 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -60.7 -39.47 88.66 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 229' ' ' LEU . 92.8 mt -62.44 -42.25 99.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.947 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 227' ' ' TRP . . . -41.19 -32.44 0.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.855 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -68.95 -67.83 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.657 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 91.0 p -66.23 -18.87 65.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.495 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -55.25 -106.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.653 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -155.83 105.03 2.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.536 HD22 ' OE2' ' A' ' 239' ' ' GLU . 70.9 mt -146.68 168.59 20.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.715 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 69.4 p -80.12 164.43 23.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.592 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -63.39 -49.4 73.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.99 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.18 -44.84 94.29 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.566 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.536 ' OE2' HD22 ' A' ' 235' ' ' LEU . 81.6 tt0 -62.95 -36.18 82.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.027 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.749 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.33 -44.05 96.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.985 0.422 . . . . 0.0 110.44 -179.691 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.64 -55.02 30.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.506 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.36 77.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.065 0.46 . . . . 0.0 110.402 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.418 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.04 -43.8 98.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.283 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -54.14 -54.21 42.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.045 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -62.54 -39.08 92.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.282 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -56.86 -51.96 67.01 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.233 0.54 . . . . 0.0 110.45 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.2 mm? -63.42 -36.86 85.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.772 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.439 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 88.7 tttt -55.94 -48.46 75.7 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.303 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . 0.405 ' O ' ' HD3' ' A' ' 253' ' ' LYS . 19.4 m-70 -66.64 -39.56 88.32 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . 0.457 ' CE2' HD11 ' A' ' 311' ' ' LEU . 3.1 m-85 -62.28 -48.96 77.6 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.005 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 14.6 pt-20 -61.47 -35.07 76.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.231 0.538 . . . . 0.0 109.644 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.05 83.06 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.282 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . 0.405 ' HD3' ' O ' ' A' ' 249' ' ' HIS . 1.9 mptm? -61.03 -46.59 90.09 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.725 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.505 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.5 tp -63.67 -37.09 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.218 -0.447 . . . . 0.0 109.891 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -56.61 -51.43 68.67 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.036 0.446 . . . . 0.0 109.87 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -61.99 -42.65 99.38 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.331 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -55.37 -44.31 75.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.199 0.523 . . . . 0.0 110.199 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -62.12 -40.15 94.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.024 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -57.8 -46.33 84.8 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.117 0.484 . . . . 0.0 110.514 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -63.69 -36.36 83.59 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.505 HE21 ' CG2' ' A' ' 297' ' ' THR . 75.3 mm-40 -58.88 -48.33 81.8 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.03 -44.88 94.33 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -63.34 -37.54 87.68 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.082 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.74 -41.86 97.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.37 -48.13 82.66 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.39 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 63.6 mt -62.15 -42.82 96.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.333 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.65 -36.91 82.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.349 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -63.34 -46.41 86.69 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.091 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.28 -45.72 92.35 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.135 0.493 . . . . 0.0 110.604 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.66 -37.77 85.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.42 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.22 -43.8 98.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.23 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -61.33 -43.24 99.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.309 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . 0.44 ' O ' ' OG ' ' A' ' 276' ' ' SER . 78.2 m80 -69.49 -40.15 77.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.756 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.647 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.6 -38.3 89.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.4 -24.43 67.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.667 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 273' ' ' HIS . 78.7 p -78.59 -5.84 53.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.637 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 274' ' ' ALA . 10.6 p -60.1 -30.13 45.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.444 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 102.42 -72.04 0.32 Allowed Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -65.01 139.09 58.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.779 0.324 . . . . 0.0 110.544 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -92.01 126.77 8.64 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -166.11 -78.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.821 0.343 . . . . 0.0 110.482 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -72.75 -6.63 45.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 54.7 t -64.2 -45.17 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.533 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 1.1 p -62.2 -44.87 95.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.848 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -62.15 -44.28 96.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.6 t -60.86 -45.39 94.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.537 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -63.57 -35.29 80.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.417 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -60.8 -61.95 2.21 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.23 0.538 . . . . 0.0 110.363 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.555 ' HD3' HD23 ' A' ' 292' ' ' LEU . 11.4 mmtm -62.01 -35.4 78.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.116 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -51.27 -48.42 62.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.879 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.07 76.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.555 HD23 ' HD3' ' A' ' 289' ' ' LYS . 17.0 tp -62.06 -52.4 64.06 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.55 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 8.8 mp -63.47 -42.59 98.59 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.196 0.522 . . . . 0.0 110.097 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.592 ' O ' ' OG1' ' A' ' 297' ' ' THR . 83.2 tt0 -63.28 -36.37 83.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.817 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.21 -44.13 97.54 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 296' ' ' ARG . 16.5 tpp180 -60.12 -43.11 95.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.468 . . . . 0.0 110.176 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.592 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 19.9 p -58.34 -43.36 88.24 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -39.85 95.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.358 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -58.41 -49.2 78.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.329 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . 0.427 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.7 OUTLIER -60.35 -43.55 96.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.512 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.27 -42.57 82.87 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -63.65 -47.14 82.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.054 0.454 . . . . 0.0 110.655 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . 0.429 HG22 ' ND1' ' A' ' 307' ' ' HIS . 10.8 m -61.5 -43.78 98.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.723 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.39 -41.82 88.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -60.19 -50.38 73.89 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-O 121.153 0.501 . . . . 0.0 110.535 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -63.04 -39.98 96.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.459 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.429 ' ND1' HG22 ' A' ' 303' ' ' THR . 3.4 m170 -66.69 -33.65 76.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.997 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.533 HD21 HG21 ' A' ' 223' ' ' VAL . 3.9 mt -61.81 -46.12 90.89 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.661 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -68.31 -41.89 80.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.52 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.07 -47.17 84.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.886 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.457 HD11 ' CE2' ' A' ' 250' ' ' PHE . 26.8 mt -62.05 -43.2 99.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.964 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 78.4 p -62.74 -36.63 83.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.511 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.27 -45.04 83.84 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.503 ' N ' ' HE ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.85 -43.0 97.44 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.029 -179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 315' ' ' ILE . 55.8 mt -86.55 -2.62 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.739 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 46.9 t -59.15 -44.3 92.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.299 0.571 . . . . 0.0 109.464 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.508 ' CG ' ' N ' ' A' ' 318' ' ' ALA . 10.5 ptp85 -106.83 -42.72 4.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.233 -0.894 . . . . 0.0 108.866 178.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.508 ' N ' ' CG ' ' A' ' 317' ' ' ARG . . . 53.82 102.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.466 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 52.6 mmm-85 -73.37 159.8 32.76 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.078 -1.419 . . . . 0.0 111.899 -178.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -96.12 23.98 6.04 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.356 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.525 ' O ' ' O ' ' A' ' 322' ' ' GLU . 82.2 m-20 -155.1 46.27 0.51 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.134 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 321' ' ' ASN . 79.9 tt0 52.86 154.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.805 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . . . . . . . . . 1.5 mp . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.726 -179.491 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 50.2 p90 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.2 m -159.62 -124.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.506 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.4 mtm-85 57.47 -172.93 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.285 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -123.51 122.18 37.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.526 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -109.49 141.21 42.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.27 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -111.93 11.19 20.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.422 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 51.23 79.34 0.35 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.485 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.34 143.9 99.5 Favored 'Trans proline' 0 N--CA 1.497 1.71 0 C-N-CA 122.618 2.212 . . . . 0.0 112.217 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.76 161.56 29.82 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.65 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.433 ' O ' ' C ' ' A' ' 11' ' ' SER . 34.3 Cg_endo -65.03 -83.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 122.709 2.273 . . . . 0.0 112.255 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 10' ' ' PRO . 43.0 t 36.05 64.38 2.31 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.531 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.03 141.61 64.84 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.633 2.222 . . . . 0.0 111.997 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -175.29 85.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.516 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 15' ' ' GLU . 86.2 mtm180 -134.88 -29.47 1.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.564 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.491 ' O ' ' O ' ' A' ' 16' ' ' SER . 96.2 mt-10 56.59 116.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.68 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' O ' ' A' ' 15' ' ' GLU . 96.1 p 50.77 168.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.752 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 158.96 -170.32 35.36 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -129.01 143.68 50.95 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.823 0.344 . . . . 0.0 110.411 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.444 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 56.1 mp0 -68.39 -43.57 77.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.912 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -123.13 173.38 7.91 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.69 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.513 ' C ' ' SD ' ' A' ' 22' ' ' MET . 87.7 mtm180 -93.8 8.61 40.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.734 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.513 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -136.21 133.88 37.55 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.263 0.554 . . . . 0.0 110.711 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 58.4 mp0 -65.72 -35.91 82.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.594 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' O ' HD23 ' A' ' 28' ' ' LEU . 64.8 mttp -58.65 -49.38 77.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.102 0.477 . . . . 0.0 110.506 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.89 -34.85 78.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.756 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -66.36 -40.67 89.93 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.54 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -62.97 -45.97 89.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.596 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 24' ' ' LYS . 3.4 mm? -61.88 -41.55 98.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.562 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.645 ' CH2' HD11 ' A' ' 42' ' ' LEU . 55.6 t-105 -62.29 -45.94 91.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.12 0.486 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.62 -45.26 89.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.694 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.24 -41.65 97.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.478 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.34 -41.7 97.48 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.746 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 99.2 mt-30 -61.89 -39.29 91.43 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.076 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.475 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 85.5 mmt-85 -64.47 -38.99 92.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.601 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.7 -39.18 93.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.752 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.746 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 28.6 m80 66.21 106.58 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.818 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.576 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -132.21 155.8 80.86 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.51 179.844 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.437 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 72.5 Cg_exo -42.31 153.38 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.545 2.163 . . . . 0.0 112.364 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 31.0 Cg_exo -59.3 -40.54 67.34 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.734 2.29 . . . . 0.0 112.23 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 79.1 t -62.07 -47.08 94.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.548 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttm-85 -65.8 -42.13 91.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.539 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.645 HD11 ' CH2' ' A' ' 29' ' ' TRP . 48.5 tp -63.6 -45.16 91.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.69 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.77 -46.68 86.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.55 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -66.63 -42.52 86.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.421 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.588 HD13 ' OH ' ' A' ' 88' ' ' TYR . 59.0 tp -63.53 -51.2 66.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.848 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -58.07 -41.96 84.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.481 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.563 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.84 -47.31 86.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.544 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -56.18 -47.36 78.46 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.458 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.426 HD13 ' O ' ' A' ' 45' ' ' LEU . 6.9 mp -59.63 -40.29 87.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.035 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -58.85 -38.36 78.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 47' ' ' ALA . 28.3 mm -63.66 -42.52 96.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.785 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -57.72 -47.2 83.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.542 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -59.8 -50.51 73.54 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.26 0.552 . . . . 0.0 110.227 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 54' ' ' ARG . 71.3 mmt-85 -62.03 -41.0 97.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.564 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.413 ' OD1' ' O ' ' A' ' 55' ' ' ASP . 66.5 t0 -62.7 -39.28 93.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.543 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -60.03 -47.69 84.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.989 0.423 . . . . 0.0 110.152 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.75 -41.24 97.42 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.366 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.39 98.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.47 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.553 ' NE1' ' OD2' ' A' ' 68' ' ' ASP . 86.5 t90 -60.77 -41.28 95.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.343 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -61.3 -46.93 88.25 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -62.62 -43.14 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.406 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.5 mt -62.18 -41.49 98.37 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.146 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.491 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 88.6 tttt -60.69 -42.05 96.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.93 -40.37 95.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -64.75 -35.98 82.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.985 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.67 58.19 0.9 Allowed Glycine 0 CA--C 1.523 0.571 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 88.6 mt -125.11 -32.38 3.0 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.685 0.279 . . . . 0.0 110.656 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.553 ' OD2' ' NE1' ' A' ' 59' ' ' TRP . 46.1 t0 -91.81 115.3 27.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.365 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -134.5 -36.37 0.87 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.459 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -65.47 -34.39 78.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.413 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.49 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 89.26 14.96 59.55 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 111.014 -0.835 . . . . 0.0 111.014 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -68.61 -34.87 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.761 0.315 . . . . 0.0 110.592 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -60.63 -60.74 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.967 0.413 . . . . 0.0 110.251 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 18.0 pt-20 -56.36 -42.09 77.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.135 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.564 ' HB1' HH12 ' A' ' 79' ' ' ARG . . . -60.25 -40.7 91.25 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.265 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -61.3 -40.83 95.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -63.5 -43.36 97.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.128 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.79 -48.73 86.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.745 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.564 HH12 ' HB1' ' A' ' 75' ' ' ALA . 94.8 mtm-85 -60.91 -40.41 93.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.086 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.449 ' O ' HG13 ' A' ' 84' ' ' ILE . 7.2 t-20 -63.41 -37.98 89.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.375 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.687 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.7 -47.53 84.21 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.189 0.519 . . . . 0.0 109.847 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -65.45 -39.6 92.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.616 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 79' ' ' ARG . 72.2 t -62.79 -45.54 98.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.356 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -59.65 -48.39 87.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.268 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.2 mm? -64.95 -41.03 95.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.965 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.23 98.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.655 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -62.54 -48.06 81.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.538 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.588 ' OH ' HD13 ' A' ' 45' ' ' LEU . 9.6 m-85 -69.07 -23.44 64.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.295 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.25 22.55 75.92 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.5 mt -87.94 5.76 39.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.776 0.322 . . . . 0.0 110.484 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 42.5 p-10 -80.13 4.45 17.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.353 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -49.53 162.55 0.7 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.7 ptpt -142.3 154.39 44.67 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.811 0.338 . . . . 0.0 110.709 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -171.78 46.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.609 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 49.1 96.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.866 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.56 -60.13 4.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.662 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -145.75 -37.45 0.26 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.698 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.5 tm0? 62.92 117.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.586 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.17 158.1 41.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.57 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.439 ' O ' ' C ' ' A' ' 101' ' ' SER . 13.5 p -110.23 -20.49 12.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.714 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.439 ' C ' ' O ' ' A' ' 100' ' ' THR . 9.2 m 36.49 59.83 0.95 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.613 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -105.35 11.83 32.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.627 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.7 m -74.31 -8.08 55.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.613 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.556 HD12 ' N ' ' A' ' 104' ' ' LEU . 10.5 mp -86.72 -171.89 3.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.341 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 52.6 m 58.89 105.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.626 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -130.69 89.82 0.29 Allowed Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.412 ' O ' ' N ' ' A' ' 109' ' ' GLU . 54.8 p -64.6 -32.8 74.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.791 0.329 . . . . 0.0 110.462 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -47.74 95.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.5 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 107' ' ' THR . 95.5 mt-10 -138.79 118.17 12.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.558 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.447 ' C ' ' H ' ' A' ' 112' ' ' LEU . 96.7 m-20 -126.95 -42.29 1.75 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.53 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 70.3 -43.0 0.54 Allowed Glycine 0 CA--C 1.524 0.622 0 N-CA-C 110.754 -0.938 . . . . 0.0 110.754 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.447 ' H ' ' C ' ' A' ' 110' ' ' ASP . 9.8 tp -166.09 -85.51 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.623 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.652 ' OD1' ' N ' ' A' ' 114' ' ' ASP . 9.6 p30 176.9 -79.3 0.0 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.56 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.652 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 1.5 m-20 -59.35 135.57 88.58 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.312 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.442 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 40.2 Cg_endo -68.47 -23.97 36.92 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.599 2.199 . . . . 0.0 111.911 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -70.11 -46.27 65.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.886 0.374 . . . . 0.0 110.9 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.449 ' N ' HD12 ' A' ' 117' ' ' LEU . 8.3 mp -72.3 -37.44 68.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.769 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.577 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.9 mt-10 -58.95 -33.31 70.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.478 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 66.6 mttm -61.25 -48.1 82.99 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.639 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.474 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 35.5 mt -66.75 -44.16 82.2 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.773 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.539 ' CD2' HD22 ' A' ' 135' ' ' LEU . 6.8 t-105 -59.22 -50.3 74.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.483 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.577 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.0 m-70 -67.8 -32.2 72.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.266 179.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 127' ' ' SER . 10.8 tptt -56.94 -51.45 69.12 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.82 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.4 ' HA ' ' OG ' ' A' ' 127' ' ' SER . . . -69.82 -47.03 64.31 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.554 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -53.86 -50.23 66.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.482 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -73.95 -42.83 59.94 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 123' ' ' LYS . 80.0 p -44.38 -29.58 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.01 0.433 . . . . 0.0 109.917 -178.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -161.4 -96.74 0.11 Allowed Glycine 0 N--CA 1.463 0.44 0 C-N-CA 119.848 -1.168 . . . . 0.0 111.581 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.787 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -154.91 22.75 0.44 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.463 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.2 m-30 -56.36 49.13 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.644 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.787 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -105.82 121.14 43.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.215 -179.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 114.63 -97.08 0.8 Allowed Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.211 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -77.33 -43.93 31.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.784 0.326 . . . . 0.0 110.989 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.463 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 58.5 mp0 -61.64 -51.74 67.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.018 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.539 HD22 ' CD2' ' A' ' 121' ' ' TRP . 1.1 mt -62.14 -40.86 97.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.261 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.69 -43.31 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -60.53 -42.57 96.76 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-O 121.199 0.523 . . . . 0.0 110.138 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mt -58.32 -43.52 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -66.81 -35.24 79.62 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.934 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -54.05 -41.4 68.08 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.076 -1.049 . . . . 0.0 108.227 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.684 ' OE1' HD21 ' A' ' 204' ' ' LEU . 50.5 mt-10 -71.45 -41.73 69.08 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.753 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.474 ' HZ ' HD13 ' A' ' 120' ' ' LEU . 3.5 m-85 -59.39 -57.7 11.83 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.66 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.467 HD23 ' HD2' ' A' ' 146' ' ' LYS . 95.8 mt -60.16 -38.98 84.82 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.206 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -54.99 -46.14 75.1 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.028 -0.669 . . . . 0.0 109.54 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.466 ' CE1' HG23 ' A' ' 197' ' ' ILE . 6.7 m-70 -60.88 -40.01 91.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.681 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.467 ' HD2' HD23 ' A' ' 143' ' ' LEU . 68.1 mttm -60.88 -44.47 97.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.456 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -70.18 -46.4 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.388 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.37 -47.04 85.92 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.05 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 37.3 t -64.56 -41.74 93.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.71 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.747 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -58.17 -44.31 87.9 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.327 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.56 -40.03 95.94 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -63.98 -50.28 69.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.954 0.406 . . . . 0.0 110.575 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -72.2 -43.75 64.03 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.984 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 150' ' ' HIS . 78.9 t -60.3 -46.71 94.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.943 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.52 -42.5 95.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.708 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.735 HD21 HD21 ' A' ' 190' ' ' LEU . 31.5 mt -63.21 -43.75 97.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.63 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -65.84 -31.3 72.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.198 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 72.4 m -67.29 -49.09 65.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.952 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.588 ' O ' ' O ' ' A' ' 162' ' ' THR . 3.9 pp -79.56 -20.29 47.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.705 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.564 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 73.4 m -60.76 -44.94 96.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.622 -179.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -62.17 -50.07 73.3 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.12 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.697 ' C ' ' H ' ' A' ' 164' ' ' GLU . 8.0 p -95.99 173.14 7.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.524 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 61.98 -20.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.02 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.697 ' H ' ' C ' ' A' ' 162' ' ' THR . 4.4 tp10 -113.98 22.69 13.67 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.867 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 8.4 tp -58.37 136.07 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.507 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.582 ' H ' ' CD2' ' A' ' 166' ' ' HIS . 0.3 OUTLIER -136.8 91.17 2.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.576 179.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.416 ' CD ' ' O ' ' A' ' 167' ' ' GLU . 3.0 pp20? -157.24 24.96 0.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.663 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -174.64 3.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.74 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 4.1 m -126.08 132.74 70.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.826 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.699 ' O ' HG23 ' A' ' 170' ' ' ILE . 19.2 tt -174.57 108.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.656 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 1.3 p -145.53 154.86 53.15 Favored Pre-proline 0 N--CA 1.454 -0.231 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.342 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -72.5 84.0 1.23 Allowed 'Trans proline' 0 C--N 1.306 -1.681 0 C-N-CA 122.648 2.232 . . . . 0.0 112.05 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 4.0 m -133.55 148.64 51.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.7 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -68.86 -23.13 64.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.296 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.651 ' O ' ' N ' ' A' ' 177' ' ' ASP . 0.5 OUTLIER -178.66 70.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.246 179.809 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 1.6 m 58.43 -68.01 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.356 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.651 ' N ' ' O ' ' A' ' 175' ' ' LEU . 35.6 p-10 -173.19 122.54 0.38 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.628 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 178' ' ' ILE . 28.4 mm -96.03 25.57 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.739 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -66.52 -37.9 86.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.357 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 172.25 80.84 0.05 OUTLIER Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.685 ' C ' ' H ' ' A' ' 183' ' ' LEU . 49.1 p -127.92 112.89 15.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.959 0.409 . . . . 0.0 110.477 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.477 ' H ' HG23 ' A' ' 182' ' ' VAL . 2.3 t -58.95 10.56 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.151 0.501 . . . . 0.0 110.576 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.685 ' H ' ' C ' ' A' ' 181' ' ' SER . 50.2 tp -59.9 -40.38 88.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.533 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.627 ' ND1' ' N ' ' A' ' 185' ' ' SER . 14.8 p80 -47.44 -45.75 25.96 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.082 0.467 . . . . 0.0 110.406 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.627 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 45.9 t -59.85 -42.23 93.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.895 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -58.56 -44.42 89.71 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.713 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -62.89 -40.83 98.73 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.126 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.2 m -61.71 -43.48 98.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.934 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -61.27 -39.8 91.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.037 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.735 HD21 HD21 ' A' ' 156' ' ' LEU . 5.4 mt -62.91 -46.21 88.89 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -69.69 -42.14 74.51 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.281 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -68.83 -43.01 76.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.565 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.552 ' O ' ' OG ' ' A' ' 196' ' ' SER . 20.5 pttt -74.24 -44.15 54.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.508 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.743 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.36 -41.69 80.28 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.875 -179.629 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.535 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.1 ptm180 -66.24 -37.31 85.2 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.552 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 91.9 p -59.09 -40.0 83.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.466 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.8 mt -63.64 -43.57 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.251 178.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -63.37 -41.02 98.8 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.636 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.456 HE22 HH12 ' A' ' 195' ' ' ARG . 95.8 mt-30 -61.11 -40.45 93.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.456 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.09 -41.26 97.99 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.467 ' HA ' HD23 ' A' ' 201' ' ' LEU . 19.7 mt -62.4 -41.09 98.4 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.059 179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.585 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.3 OUTLIER -63.27 -36.05 82.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.544 ' HA ' ' HE ' ' A' ' 206' ' ' ARG . 3.5 tmm_? -63.46 -42.61 98.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.538 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.684 HD21 ' OE1' ' A' ' 141' ' ' GLU . 40.6 mt -62.15 -40.08 94.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.293 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.523 ' O ' ' ND1' ' A' ' 209' ' ' HIS . 74.4 mtp85 -62.39 -42.67 99.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.086 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.754 ' O ' ' N ' ' A' ' 210' ' ' GLN . 85.2 mtm180 -64.72 -39.32 93.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.183 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.528 ' O ' ' CA ' ' A' ' 211' ' ' GLY . 41.3 t -64.75 -44.32 96.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.105 0.479 . . . . 0.0 110.521 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 36.6 m -73.93 -26.7 60.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.484 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . 0.523 ' ND1' ' O ' ' A' ' 205' ' ' ARG . 57.0 m80 -100.57 -26.18 13.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.176 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.754 ' N ' ' O ' ' A' ' 206' ' ' ARG . 7.2 tp-100 -119.7 -29.62 4.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.881 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.528 ' CA ' ' O ' ' A' ' 207' ' ' VAL . . . -77.48 39.44 1.71 Allowed Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -107.84 145.94 32.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.737 0.303 . . . . 0.0 110.639 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.523 ' O ' HG23 ' A' ' 214' ' ' THR . 36.5 t -64.51 139.17 58.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.602 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.523 HG23 ' O ' ' A' ' 213' ' ' SER . 23.3 p -157.22 79.83 0.9 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.454 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -174.93 43.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.743 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -172.87 152.02 2.34 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.644 ' O ' ' CD2' ' A' ' 218' ' ' PHE . 55.1 mp0 -136.31 -16.91 1.59 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.845 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.644 ' CD2' ' O ' ' A' ' 217' ' ' GLU . 2.3 m-85 176.38 -15.74 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.748 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.546 ' O ' ' C ' ' A' ' 220' ' ' GLU . 84.2 tt0 -66.3 -46.69 76.09 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.042 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.546 ' C ' ' O ' ' A' ' 219' ' ' GLU . 23.7 tt0 27.06 94.3 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.609 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -47.96 82.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.471 2.114 . . . . 0.0 112.132 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 220' ' ' GLU . 56.8 ttm-85 -162.24 -50.9 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.585 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.479 HG23 ' H ' ' A' ' 224' ' ' ILE . 0.0 OUTLIER -64.59 -71.96 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.607 0 CA-C-O 121.328 0.585 . . . . 0.0 110.832 -179.684 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.479 ' H ' HG23 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -60.01 -25.58 33.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.342 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.14 -43.97 85.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.35 0.595 . . . . 0.0 109.64 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.41 -41.97 97.98 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -61.71 -36.66 81.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.798 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.63 -37.45 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.214 0.531 . . . . 0.0 109.745 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.666 ' C ' ' H ' ' A' ' 231' ' ' GLN . 94.0 mt -64.39 -41.49 96.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.82 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 235' ' ' LEU . . . -58.54 10.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.868 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.795 ' O ' HD21 ' A' ' 240' ' ' LEU . 2.8 pt20 -76.78 -47.44 21.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.703 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.43 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 76.8 p -129.66 9.52 5.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.644 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 234' ' ' ASN . . . -56.58 -49.6 74.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.578 -179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 233' ' ' ALA . 29.7 t30 173.66 74.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.636 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.494 ' N ' HD12 ' A' ' 235' ' ' LEU . 0.7 OUTLIER -136.05 172.64 12.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 -179.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.436 HG21 ' O ' ' A' ' 320' ' ' HIS . 43.2 p -94.07 167.02 11.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.72 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -62.52 -48.38 79.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.064 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.95 -45.0 95.58 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.43 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -62.5 -34.9 77.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.634 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.795 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -63.14 -41.51 99.31 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.534 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -63.85 -51.42 64.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.69 98.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.1 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -64.04 -43.14 96.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.91 178.838 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -57.3 -51.19 70.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.358 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -66.51 -40.37 89.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.585 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -59.36 -51.04 71.65 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.402 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.414 ' HG ' ' CE2' ' A' ' 243' ' ' PHE . 4.3 mm? -64.29 -37.04 86.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.563 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.691 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 33.6 ttpt -56.46 -43.8 79.92 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.192 0.52 . . . . 0.0 110.184 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -69.58 -42.71 74.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.488 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . 0.524 ' CE2' HD11 ' A' ' 311' ' ' LEU . 3.1 m-85 -61.93 -48.74 79.05 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.21 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.691 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 2.5 pp20? -60.27 -38.33 83.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.134 0.492 . . . . 0.0 109.905 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 251' ' ' GLU . . . -66.64 -36.59 82.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.366 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.23 -47.61 83.67 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.174 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.457 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.7 OUTLIER -65.1 -41.91 93.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.592 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . 0.401 ' N ' HG23 ' A' ' 254' ' ' ILE . 49.6 tp10 -61.4 -46.73 88.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.319 0.58 . . . . 0.0 110.112 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.57 -41.72 98.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.332 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -55.02 -45.44 75.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.124 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -61.3 -42.94 99.5 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.15 0.5 . . . . 0.0 110.19 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.4 -41.18 96.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.166 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . 0.425 ' O ' ' N ' ' A' ' 264' ' ' LEU . 26.0 m-85 -63.65 -37.29 86.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.522 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.481 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 35.3 mm-40 -60.3 -52.02 67.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.229 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.69 -45.31 94.66 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.081 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -67.37 -30.44 70.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.277 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' A' ' 260' ' ' TYR . 46.4 tp -63.52 -45.4 90.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.047 0.451 . . . . 0.0 110.308 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.37 -47.63 69.84 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.519 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 97.6 mt -62.42 -43.06 97.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.943 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.056 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -59.56 -46.94 87.43 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.08 0.466 . . . . 0.0 110.193 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -62.6 -43.82 97.85 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.278 0.561 . . . . 0.0 110.479 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.08 -39.51 90.18 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.327 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.728 ' C ' HD23 ' A' ' 271' ' ' LEU . 7.4 tt -59.85 -43.83 94.44 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.3 ttt85 -58.45 -44.46 89.24 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.126 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -68.52 -40.2 80.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.567 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.619 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -57.24 -44.21 83.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.692 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . 0.587 ' OE2' HD21 ' A' ' 271' ' ' LEU . 92.2 mt-10 -61.66 -22.28 65.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.494 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.5 t -91.85 5.84 48.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.626 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.619 HG12 ' O ' ' A' ' 274' ' ' ALA . 14.5 p -62.44 -43.66 98.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.61 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.556 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 166.41 -111.83 0.47 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -61.53 -41.01 96.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.78 0.324 . . . . 0.0 110.563 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 281' ' ' GLU . . . 152.72 -111.69 0.5 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . 0.636 ' C ' ' H ' ' A' ' 283' ' ' VAL . 95.5 mt-10 58.9 152.66 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' A' ' 281' ' ' GLU . 96.8 mtt180 64.26 -19.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.751 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . 0.636 ' H ' ' C ' ' A' ' 281' ' ' GLU . 8.9 p -67.91 -47.42 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.696 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . 0.596 ' N ' HG13 ' A' ' 283' ' ' VAL . 42.1 m -63.41 -44.94 93.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.941 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -65.73 -43.53 88.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.833 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 59.1 m -61.11 -44.98 96.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.794 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . 0.553 ' NH2' ' OE2' ' A' ' 275' ' ' GLU . 94.8 mtt-85 -66.03 -39.61 90.34 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.189 0.519 . . . . 0.0 111.045 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.97 -59.21 5.82 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.073 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.647 ' HD3' HD23 ' A' ' 292' ' ' LEU . 54.6 mmtt -63.41 -39.88 95.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.07 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -41.81 -57.78 2.24 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.382 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.37 80.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.717 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.647 HD23 ' HD3' ' A' ' 289' ' ' LYS . 35.6 tp -60.65 -49.87 75.77 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.499 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . 0.442 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.8 mp -64.93 -41.63 95.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.978 0.418 . . . . 0.0 110.06 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -58.93 -45.35 90.59 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.182 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.28 -43.83 98.54 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -62.72 -38.87 92.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.419 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.481 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 1.5 m -60.75 -51.71 68.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.395 0.617 . . . . 0.0 110.076 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -65.3 -44.95 86.27 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.246 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -58.39 -38.01 76.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.987 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 300' ' ' LEU . 0.2 OUTLIER -62.72 -42.82 99.85 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.66 -46.19 93.68 Favored Glycine 0 CA--C 1.53 1.009 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.62 -43.51 93.75 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 110.45 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.8 m -60.26 -41.64 93.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.128 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.83 -43.86 89.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -57.6 -55.11 39.07 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.244 0.545 . . . . 0.0 110.619 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -62.73 -38.47 90.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.425 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -63.35 -38.01 89.51 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.279 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 6.8 mt -62.02 -44.56 96.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.343 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? -70.59 -43.2 69.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.704 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -63.34 -46.02 88.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.836 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 250' ' ' PHE . 23.9 mt -63.43 -42.11 98.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.92 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 67.8 m -58.97 -44.29 91.5 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.362 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -71.04 -36.64 64.35 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.588 ' O ' HD22 ' A' ' 323' ' ' LEU . 43.5 ttm180 -63.2 -43.89 96.91 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.732 0.301 . . . . 0.0 110.758 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.591 ' O ' ' N ' ' A' ' 317' ' ' ARG . 2.3 mt -81.29 -97.16 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.904 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 315' ' ' ILE . 0.4 OUTLIER 35.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.095 0.474 . . . . 0.0 110.444 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.613 ' HD3' ' HE ' ' A' ' 319' ' ' ARG . 17.6 ptp180 -70.33 -36.95 74.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.465 -178.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.508 ' N ' ' O ' ' A' ' 315' ' ' ILE . . . 50.83 91.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.613 ' HE ' ' HD3' ' A' ' 317' ' ' ARG . 18.0 mmt85 -69.98 160.99 30.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.982 -178.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . 0.463 ' CG ' ' N ' ' A' ' 321' ' ' ASN . 47.0 p-80 -56.44 -42.88 78.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.417 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.463 ' N ' ' CG ' ' A' ' 320' ' ' HIS . 95.9 m-20 -96.64 148.96 22.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.768 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -48.37 128.35 14.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.25 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.588 HD22 ' O ' ' A' ' 314' ' ' ARG . 2.7 mp . . . . . 0 C--O 1.219 -0.511 0 CA-C-O 118.088 -0.958 . . . . 0.0 110.636 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.5 m -72.38 146.93 46.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.307 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.486 ' O ' ' O ' ' A' ' 4' ' ' GLU . 56.7 ttt180 -129.49 99.15 5.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.36 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 3' ' ' ARG . 83.2 tt0 33.47 97.15 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.121 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -66.79 131.46 45.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.469 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -135.71 -89.82 0.31 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.535 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -150.87 153.32 33.24 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.373 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.14 156.22 29.79 Favored 'Trans proline' 0 N--CA 1.498 1.742 0 C-N-CA 123.063 2.509 . . . . 0.0 112.595 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.691 ' H ' ' HD2' ' A' ' 10' ' ' PRO . 3.7 tmtt? -156.75 -50.99 0.01 OUTLIER Pre-proline 0 N--CA 1.469 0.51 0 CA-C-N 116.746 -0.207 . . . . 0.0 111.46 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.691 ' HD2' ' H ' ' A' ' 9' ' ' LYS . 41.9 Cg_endo -77.18 114.81 3.85 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 121.914 1.742 . . . . 0.0 112.267 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.465 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 3.5 m 178.52 51.44 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.562 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.465 ' CD ' ' N ' ' A' ' 11' ' ' SER . 38.9 Cg_endo -65.53 144.16 78.11 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.589 2.193 . . . . 0.0 111.834 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -111.84 87.76 2.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.093 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -87.4 126.53 34.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.244 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -109.97 -6.94 15.04 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.958 0.409 . . . . 0.0 110.44 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 87.0 p -75.23 161.15 29.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.63 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -145.7 -174.29 17.74 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -137.14 174.5 10.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.69 0.281 . . . . 0.0 110.415 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -65.26 -35.19 80.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.852 0.358 . . . . 0.0 110.531 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.435 ' CD1' HD23 ' A' ' 25' ' ' LEU . 67.0 m-85 -133.83 158.77 42.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.892 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 21' ' ' ARG . 68.3 mtt180 -94.4 16.45 15.14 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.901 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.581 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.5 mmt -142.29 133.9 26.75 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.113 0.482 . . . . 0.0 111.217 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -67.3 -43.99 80.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.539 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -60.01 -45.69 91.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.419 0.628 . . . . 0.0 110.5 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.435 HD23 ' CD1' ' A' ' 20' ' ' PHE . 5.3 tp -60.76 -38.77 86.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.402 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.581 ' ND2' ' O ' ' A' ' 22' ' ' MET . 49.6 m-80 -62.37 -39.29 92.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.814 179.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -57.59 -46.25 84.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.258 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -61.42 -43.2 99.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.095 0.474 . . . . 0.0 110.41 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.404 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 24.8 t-105 -60.91 -45.41 94.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.235 0.54 . . . . 0.0 110.595 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -59.41 -40.61 87.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.264 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.402 ' HG2' ' NH2' ' A' ' 34' ' ' ARG . 67.3 mttm -60.57 -43.3 97.44 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.255 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.99 97.17 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.284 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.541 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 77.3 mt-30 -58.16 -45.07 88.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.344 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.486 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 93.7 mtm-85 -65.65 -33.98 77.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.48 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.459 HD12 ' HA ' ' A' ' 35' ' ' LEU . 14.3 tp -62.09 -37.57 85.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.127 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.541 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 26.8 m80 65.94 109.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 mt -139.3 154.96 72.4 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.02 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 154.6 0.1 OUTLIER 'Trans proline' 0 C--N 1.312 -1.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.26 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.14 -34.7 16.02 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.461 2.108 . . . . 0.0 112.321 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.49 -48.91 81.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.617 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -69.94 -39.97 75.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.586 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.7 -43.89 95.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.586 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.09 -44.4 84.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.612 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -66.88 -45.73 77.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.643 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.405 HD22 ' OH ' ' A' ' 88' ' ' TYR . 57.1 tp -62.67 -47.91 81.61 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.534 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -59.03 -40.71 85.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.973 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.93 -45.13 93.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.812 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.07 -46.4 85.5 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.915 0.388 . . . . 0.0 110.409 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 40.6 mt -60.01 -40.84 90.65 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.128 0.489 . . . . 0.0 110.158 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -59.0 -39.64 82.42 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.059 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.4 mm -62.13 -43.8 98.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.648 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -55.74 -44.83 77.95 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.389 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -60.41 -46.73 88.94 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.261 0.553 . . . . 0.0 110.425 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.62 -43.34 93.84 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.7 -38.64 85.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.115 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -58.07 -47.32 83.52 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 16.0 mt -60.84 -42.6 98.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.391 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.09 99.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.5 t90 -57.6 -43.14 84.46 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.135 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.66 -45.87 92.19 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.03 0.443 . . . . 0.0 109.931 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.09 -44.45 91.91 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.431 ' CD2' ' NZ ' ' A' ' 73' ' ' LYS . 7.2 mp -62.72 -39.04 92.82 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.848 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.51 -44.55 76.73 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 30.6 mt -62.2 -41.38 98.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.038 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.61 -37.45 86.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.37 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.12 33.04 5.61 Favored Glycine 0 CA--C 1.528 0.87 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.6 mt -89.04 -56.53 3.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.84 0.352 . . . . 0.0 110.786 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 68' ' ' ASP . 10.0 p-10 -75.88 145.06 40.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -143.98 -50.74 0.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.454 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.89 -33.28 75.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.224 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.56 21.86 39.02 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -60.46 -33.97 73.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.431 ' NZ ' ' CD2' ' A' ' 62' ' ' LEU . 98.4 mttt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.042 0.449 . . . . 0.0 110.096 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -58.07 -42.88 86.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.147 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.51 92.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.371 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.407 ' HA ' ' HE ' ' A' ' 79' ' ' ARG . 61.3 ttp180 -60.37 -42.73 96.42 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.62 -42.83 99.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.4 mt -63.7 -45.52 97.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.626 ' O ' HG23 ' A' ' 83' ' ' VAL . 88.8 mtm180 -61.58 -41.73 97.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.205 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -63.9 -38.94 92.95 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.294 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.741 ' C ' HD13 ' A' ' 81' ' ' LEU . 2.9 tm? -59.54 -48.52 81.32 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.755 -0.778 . . . . 0.0 109.841 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -63.6 -38.67 92.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.639 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 79' ' ' ARG . 78.2 t -62.81 -46.42 96.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.346 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.32 -48.89 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.52 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.434 HD12 ' H ' ' A' ' 91' ' ' ASP . 4.0 mm? -65.49 -40.8 93.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.4 . . . . 0.0 110.897 178.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.85 -47.74 83.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.68 -44.13 97.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.104 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.405 ' OH ' HD22 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -63.43 -34.69 78.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.106 0.479 . . . . 0.0 109.954 179.739 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.46 25.9 55.76 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.822 ' O ' ' N ' ' A' ' 92' ' ' GLY . 45.9 mt -86.24 -83.29 0.18 Allowed 'General case' 0 C--O 1.231 0.107 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.513 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.434 ' H ' HD12 ' A' ' 85' ' ' LEU . 32.2 t70 53.54 -53.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.807 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.822 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . 107.62 -2.71 34.28 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 44.4 tptt -66.07 133.6 51.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.79 0.329 . . . . 0.0 110.35 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.451 ' O ' ' O ' ' A' ' 95' ' ' ASP . 54.9 tptt -58.18 -76.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.495 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 96' ' ' ALA . 42.8 t0 44.94 -173.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.359 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.518 ' N ' ' OD1' ' A' ' 95' ' ' ASP . . . -152.23 151.33 30.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.739 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.546 ' O ' ' O ' ' A' ' 98' ' ' GLN . 90.5 mtm-85 -142.33 112.81 7.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.519 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.546 ' O ' ' O ' ' A' ' 97' ' ' ARG . 48.1 tt0 53.16 122.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.502 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 59.5 t -108.77 131.95 58.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.29 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.6 p -65.63 153.55 41.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.293 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.6 m -59.38 -41.98 90.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.505 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -151.56 -85.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.555 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.6 p -163.11 1.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.768 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.4 ' N ' HD23 ' A' ' 104' ' ' LEU . 0.2 OUTLIER -112.95 124.15 51.97 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.738 0.304 . . . . 0.0 110.467 179.689 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 86.6 p -159.0 161.94 36.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.579 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.433 ' O ' ' N ' ' A' ' 108' ' ' GLN . . . 55.33 -95.06 0.03 OUTLIER Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.8 m 67.67 -59.9 0.4 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.721 0.296 . . . . 0.0 110.818 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.433 ' N ' ' O ' ' A' ' 106' ' ' GLY . 13.6 pt20 -146.8 145.5 29.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.546 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -145.56 112.95 6.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.444 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -134.1 -85.11 0.43 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.492 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.43 -104.3 0.19 Allowed Glycine 0 CA--C 1.52 0.345 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.7 tp -134.94 -85.92 0.39 Allowed 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 121.005 -0.278 . . . . 0.0 110.929 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.3 t0 174.81 -83.04 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.531 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -52.07 113.65 4.48 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.548 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -51.19 -35.6 52.94 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.325 2.017 . . . . 0.0 112.323 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 95.5 mtm-85 -61.17 -45.01 96.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.915 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.09 -39.46 82.88 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.408 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.597 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 99.1 mt-10 -54.84 -24.65 24.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.259 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 57.0 mtpt -60.15 -49.72 76.53 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.927 -0.709 . . . . 0.0 110.096 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.87 -44.75 69.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.975 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.69 ' CE2' HD13 ' A' ' 135' ' ' LEU . 9.2 t-105 -59.07 -48.84 80.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.49 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.597 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.435 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.2 OUTLIER -55.91 -51.28 68.16 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.729 -178.812 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.29 -46.7 63.76 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.814 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -51.68 -51.53 55.18 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.648 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 4.6 m -76.68 -41.99 43.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.821 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.9 t -45.55 -27.34 0.73 Allowed 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.062 0.458 . . . . 0.0 109.912 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.12 -91.79 0.08 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.426 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.541 ' O ' ' N ' ' A' ' 131' ' ' SER . 11.8 ptmt -165.62 31.03 0.05 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.413 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.3 m-85 -65.13 43.4 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.341 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.541 ' N ' ' O ' ' A' ' 129' ' ' LYS . 6.7 m -98.36 123.54 42.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.651 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 112.7 -97.29 0.88 Allowed Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.076 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -78.61 -43.24 26.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.749 0.309 . . . . 0.0 111.246 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 77.3 mm-40 -60.97 -51.97 66.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 0.0 110.142 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.69 HD13 ' CE2' ' A' ' 121' ' ' TRP . 2.2 mt -62.43 -42.89 99.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.035 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.21 -39.95 92.15 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 2.9 mmpt? -61.49 -42.1 98.28 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.281 0.562 . . . . 0.0 109.869 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mt -58.05 -43.39 86.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -36.15 82.74 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 176.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.507 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 6.5 mpt_? -54.12 -42.95 70.03 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.522 ' OE1' ' O ' ' A' ' 137' ' ' LYS . 5.6 mp0 -70.09 -41.86 73.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.825 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -61.06 -53.73 53.52 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.693 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 98.9 mt -59.92 -40.71 89.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.097 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' A' ' 140' ' ' ARG . 6.4 m80 -56.48 -44.28 80.48 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.478 ' O ' HG12 ' A' ' 149' ' ' VAL . 9.5 m-70 -63.28 -38.68 92.11 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.592 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -60.82 -43.14 98.6 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.106 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.722 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 98.1 mt-10 -69.83 -45.71 67.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.002 0.429 . . . . 0.0 111.684 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -70.65 -44.53 66.9 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.481 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.6 HG13 ' N ' ' A' ' 150' ' ' HIS . 4.4 p -63.44 -49.34 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.983 -178.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.783 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -70.51 -23.25 62.62 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.004 -179.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.682 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 24.6 mt-10 -67.18 -52.28 43.3 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.814 179.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -63.25 -41.53 99.07 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -63.92 -40.1 95.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.231 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 150' ' ' HIS . 19.8 t -60.38 -47.65 91.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.042 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.44 -43.76 93.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.844 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.547 HD21 HD21 ' A' ' 190' ' ' LEU . 19.7 mt -63.31 -42.3 99.01 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.647 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -65.07 -33.88 77.08 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.089 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 63.9 m -64.43 -49.95 69.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.823 -179.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 1.8 pp -78.87 -21.4 47.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.638 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.508 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 37.0 m -61.62 -32.33 72.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.869 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -53.0 -42.73 65.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.721 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.57 24.78 0.45 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.494 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -117.1 -27.6 6.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.994 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -103.17 61.49 0.78 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.941 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.714 HG23 ' O ' ' A' ' 165' ' ' ILE . 1.4 tt -134.46 103.67 4.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.483 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 29.3 m170 44.63 32.03 0.71 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.114 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 51.4 tp10 -93.09 116.8 29.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.592 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 45.7 p30 -158.92 18.64 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.54 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 1.5 m -123.47 129.27 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.602 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.6 tt -158.92 147.51 7.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.665 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -135.53 164.43 43.6 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.453 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.39 -30.94 65.73 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.814 2.342 . . . . 0.0 112.061 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.535 ' O ' ' N ' ' A' ' 175' ' ' LEU . 8.4 m -55.18 -14.79 1.83 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.678 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 13.5 t70 65.54 -41.9 0.34 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.579 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' A' ' 173' ' ' SER . 6.4 tp -162.72 46.95 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.427 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.507 ' O ' ' O ' ' A' ' 177' ' ' ASP . 12.8 t 49.07 67.12 0.93 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.479 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.507 ' O ' ' O ' ' A' ' 176' ' ' SER . 65.7 t0 56.05 124.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.806 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.426 HD11 ' HB3' ' A' ' 175' ' ' LEU . 96.3 mt -121.03 130.38 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.175 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.622 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -128.96 12.3 6.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.582 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 136.14 93.71 0.39 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.674 ' C ' ' H ' ' A' ' 183' ' ' LEU . 82.7 p -121.68 15.04 11.02 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.548 0.213 . . . . 0.0 110.604 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.469 HG12 ' O ' ' A' ' 182' ' ' VAL . 20.4 t 55.76 -7.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.751 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.674 ' H ' ' C ' ' A' ' 181' ' ' SER . 14.2 tp -62.34 -41.12 98.33 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.282 0.563 . . . . 0.0 110.687 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.418 ' CD2' ' H ' ' A' ' 184' ' ' HIS . 2.6 p80 -48.02 -34.23 9.11 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.309 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 47.0 t -60.27 -45.2 94.13 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.14 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.648 HH21 ' CD1' ' A' ' 183' ' ' LEU . 59.3 mtm180 -65.68 -39.42 91.29 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.544 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -66.3 -41.79 89.23 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.61 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 59.6 m -62.51 -44.61 95.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.325 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -63.48 -39.46 94.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.052 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.547 HD21 HD21 ' A' ' 156' ' ' LEU . 5.3 mt -62.3 -46.68 87.69 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.556 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.442 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.8 mttt -68.6 -38.27 80.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.942 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 85.4 tt0 -67.81 -48.21 66.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.764 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 14.3 pttt -73.2 -41.18 64.09 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.011 -179.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.705 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.52 -41.77 72.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.849 -179.4 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.523 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 12.8 ptm180 -65.72 -38.99 90.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 78.0 p -61.0 -42.29 98.16 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 193' ' ' LYS . 82.2 mt -64.42 -43.86 97.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.761 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -62.09 -41.7 98.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.504 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.29 -31.94 73.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.338 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.57 78.41 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 201' ' ' LEU . 24.8 mt -63.22 -40.8 98.5 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.864 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.56 -39.96 93.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -41.76 99.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.497 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.449 HD12 HD23 ' A' ' 201' ' ' LEU . 31.9 mt -60.9 -40.66 93.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.449 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -62.2 -44.24 97.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.294 0.569 . . . . 0.0 109.668 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.547 ' O ' ' N ' ' A' ' 210' ' ' GLN . 24.2 mmt85 -63.73 -39.54 94.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.069 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 211' ' ' GLY . 48.5 t -62.99 -45.64 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.042 0.449 . . . . 0.0 109.897 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 15.6 m -63.39 -29.51 70.8 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.339 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.9 m170 -93.57 -46.03 7.47 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.69 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.641 ' C ' ' H ' ' A' ' 212' ' ' TYR . 2.9 pp0? -105.56 -25.57 12.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.657 0.265 . . . . 0.0 111.112 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -61.42 8.17 0.12 Allowed Glycine 0 N--CA 1.459 0.202 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.641 ' H ' ' C ' ' A' ' 210' ' ' GLN . 65.2 t80 -66.98 166.94 12.64 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.186 0.517 . . . . 0.0 111.441 -179.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.6 ' N ' ' CG ' ' A' ' 212' ' ' TYR . 16.8 p -43.31 104.13 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.201 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 1.9 p -131.86 166.47 21.52 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.37 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -91.75 164.85 13.56 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.077 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 217' ' ' GLU . . . 65.1 -175.0 0.18 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.679 0.276 . . . . 0.0 110.846 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.454 ' HB3' ' O ' ' A' ' 216' ' ' ALA . 67.3 tt0 81.34 35.54 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -114.41 104.27 11.89 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -139.6 -34.61 0.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.329 -0.949 . . . . 0.0 112.698 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.97 151.24 86.31 Favored Pre-proline 0 C--O 1.235 0.325 0 C-N-CA 119.136 -1.025 . . . . 0.0 108.314 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.616 ' O ' ' N ' ' A' ' 223' ' ' VAL . 78.0 Cg_exo -38.26 -79.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.28 1.987 . . . . 0.0 112.418 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.413 ' H ' ' HB2' ' A' ' 221' ' ' PRO . 43.6 ttm180 36.09 -84.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.092 0.472 . . . . 0.0 111.402 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.817 HG11 HD21 ' A' ' 308' ' ' LEU . 2.1 t -59.75 -65.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.139 0.495 . . . . 0.0 110.691 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.414 HD11 ' HE1' ' A' ' 250' ' ' PHE . 1.1 mp -51.19 -28.03 6.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.754 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . 0.409 ' HB3' ' O ' ' A' ' 222' ' ' ARG . 56.6 t0 -63.51 -45.91 88.47 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 109.868 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.1 mt -61.2 -42.13 98.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.596 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.452 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 44.2 m0 -61.49 -36.67 81.12 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.355 -0.538 . . . . 0.0 109.949 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.8 -40.21 94.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 231' ' ' GLN . 96.8 mt -64.02 -41.81 97.33 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.263 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 227' ' ' TRP . . . -36.68 -29.39 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.999 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 229' ' ' LEU . 89.1 mt-30 -62.49 -65.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.715 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 5.4 t -87.05 14.69 7.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.688 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -80.47 -76.1 0.24 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.805 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -173.26 81.66 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.905 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 76.5 mt -141.54 149.26 40.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.615 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 240' ' ' LEU . 70.4 p -71.3 -167.01 0.2 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.407 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 237' ' ' ASP . 27.0 p-10 -82.53 -47.82 11.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.327 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . 0.401 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 65.1 mttp -63.38 -44.33 95.03 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.081 0.467 . . . . 0.0 110.625 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 322' ' ' GLU . 93.7 mt-10 -62.3 -36.45 82.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.686 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.758 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.2 -45.0 93.73 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.535 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -62.08 -46.73 87.81 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.465 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -63.24 -40.85 98.6 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.06 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.526 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -65.71 -43.73 88.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.52 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . 0.401 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 0.0 OUTLIER -59.99 -48.21 82.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.009 0.433 . . . . 0.0 110.441 -178.703 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -65.19 -46.08 82.2 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.825 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -57.27 -50.17 73.76 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.071 0.462 . . . . 0.0 110.345 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.97 -37.39 87.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.687 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.4 tttt -55.28 -47.63 75.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.061 0.458 . . . . 0.0 109.866 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -67.48 -43.77 80.16 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.076 -0.649 . . . . 0.0 110.989 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . 0.436 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 29.9 t80 -60.65 -48.06 83.46 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.509 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 0.9 OUTLIER -61.86 -36.63 81.81 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.04 -41.6 90.66 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.826 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.45 -46.9 86.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 111.137 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -38.81 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.791 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -55.83 -48.8 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.343 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -62.24 -43.11 99.57 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.26 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -57.83 -43.1 85.6 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.131 0.491 . . . . 0.0 110.291 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -61.52 -40.97 96.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.364 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -59.18 -46.69 87.74 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 120.954 0.407 . . . . 0.0 110.285 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . 0.56 ' CD2' HD11 ' A' ' 293' ' ' LEU . 3.3 m-85 -62.07 -37.5 85.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.28 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.549 HE21 ' CG2' ' A' ' 297' ' ' THR . 90.0 mm-40 -61.6 -42.62 99.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.524 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 24.1 mmtp -62.0 -45.64 92.74 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.098 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -66.34 -35.99 81.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.148 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 54.0 tp -62.31 -43.73 98.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.39 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.46 -45.38 83.98 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.677 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 55.9 mt -62.97 -43.27 98.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.734 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.14 -38.63 83.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.035 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.29 -47.42 86.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.407 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -58.43 -48.85 79.37 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.361 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -61.11 -37.66 83.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.729 ' O ' HD23 ' A' ' 271' ' ' LEU . 4.7 tt -59.81 -44.26 94.07 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 -179.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -61.35 -44.81 96.55 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.078 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.49 -44.6 82.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.863 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.03 -34.69 73.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -59.92 -35.16 74.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.962 0.411 . . . . 0.0 110.116 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 15.6 m -61.25 -31.47 71.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.834 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.34 -44.04 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.453 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 105.03 6.1 40.12 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . 0.433 ' O ' HG23 ' A' ' 283' ' ' VAL . 48.9 t0 -84.35 100.47 11.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.379 . . . . 0.0 110.127 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.3 86.87 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -55.58 -50.8 69.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.582 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -66.53 -38.28 86.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.93 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 279' ' ' ASP . 72.5 t -60.87 -47.29 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 10.8 t -62.48 -46.4 88.65 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.054 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -62.44 -43.03 99.81 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.706 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 37.2 t -60.47 -45.14 94.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.459 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -64.07 -36.65 84.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.708 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.61 -58.87 6.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.551 ' HD3' HD23 ' A' ' 292' ' ' LEU . 28.5 mmtt -64.34 -33.48 75.94 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.061 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 -55.26 -48.67 73.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.443 -0.503 . . . . 0.0 109.919 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.84 -39.1 80.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.964 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.551 HD23 ' HD3' ' A' ' 289' ' ' LYS . 8.5 tp -62.28 -54.92 33.71 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.736 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . 0.56 HD11 ' CD2' ' A' ' 260' ' ' TYR . 9.8 tp -62.65 -42.43 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.181 0.515 . . . . 0.0 109.958 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.484 ' O ' ' OG1' ' A' ' 297' ' ' THR . 81.7 tt0 -63.35 -36.98 85.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.993 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.47 -45.71 94.21 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -60.56 -44.03 96.63 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.056 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.549 ' CG2' HE21 ' A' ' 261' ' ' GLN . 21.9 p -59.39 -39.84 84.66 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.563 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.77 -47.47 83.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.029 0.442 . . . . 0.0 110.838 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -60.2 -41.29 92.67 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.092 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . 0.43 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.1 OUTLIER -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.953 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.44 -40.0 91.47 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -61.54 -46.7 88.82 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 110.486 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 17.7 m -60.34 -45.21 94.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.542 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.98 -42.18 91.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.854 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -56.59 -48.75 76.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.752 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -61.56 -42.89 99.5 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.185 0.517 . . . . 0.0 110.457 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -68.95 -31.09 69.71 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.311 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.817 HD21 HG11 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -61.94 -49.01 77.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.327 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . 0.421 ' HG3' ' N ' ' A' ' 310' ' ' ASP . 12.5 pt20 -67.88 -42.0 81.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . 0.444 ' OD1' ' NE ' ' A' ' 314' ' ' ARG . 48.4 t0 -62.29 -51.1 69.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.995 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.45 -40.19 95.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.883 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 66.5 m -58.58 -44.79 89.92 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.64 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -70.13 -45.47 55.98 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.462 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.444 ' NE ' ' OD1' ' A' ' 310' ' ' ASP . 95.1 mtt-85 -63.44 -47.52 81.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.724 0.297 . . . . 0.0 111.23 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -65.59 -43.19 94.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.643 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.0 p -58.51 -38.08 76.94 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.508 -0.477 . . . . 0.0 109.932 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.642 ' HG3' ' H ' ' A' ' 319' ' ' ARG . 43.2 tpt85 -86.38 -50.25 7.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.775 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.651 ' HA ' HD11 ' A' ' 323' ' ' LEU . . . 52.09 6.69 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -178.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.642 ' H ' ' HG3' ' A' ' 317' ' ' ARG . 96.0 mtm-85 24.76 -104.85 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.391 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -163.72 -52.11 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.264 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.649 ' O ' ' O ' ' A' ' 322' ' ' GLU . 35.2 t30 -90.81 86.75 6.41 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.373 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.649 ' O ' ' O ' ' A' ' 321' ' ' ASN . 0.9 OUTLIER 39.1 178.33 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.376 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.651 HD11 ' HA ' ' A' ' 318' ' ' ALA . 81.8 mt . . . . . 0 C--O 1.219 -0.512 0 CA-C-O 117.865 -1.064 . . . . 0.0 109.966 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 57.7 t80 . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -89.11 -3.65 58.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.821 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -72.26 142.72 48.93 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.595 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -148.59 134.38 18.92 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.6 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -150.64 138.85 20.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.401 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -175.94 138.49 0.36 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.589 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -152.64 148.34 20.55 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.286 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.74 157.6 59.86 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.994 2.463 . . . . 0.0 112.502 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -101.45 109.63 59.49 Favored Pre-proline 0 CA--C 1.533 0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.138 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.19 155.42 42.07 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 C-N-CA 122.666 2.244 . . . . 0.0 112.044 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.7 p -149.38 77.82 8.76 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.639 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -59.01 146.2 95.0 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.52 2.147 . . . . 0.0 112.032 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -121.99 146.37 47.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.362 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 71.0 ttt180 -96.22 -85.37 0.34 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.281 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 57.56 109.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.501 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.2 t -159.75 167.75 27.54 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.751 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -168.67 -157.84 11.93 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.095 -0.802 . . . . 0.0 111.095 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 61.64 60.18 1.68 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.649 0.262 . . . . 0.0 110.365 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.74 -35.86 75.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.885 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -125.57 161.52 27.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.923 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -65.47 -34.62 78.7 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.0 mmm -124.18 149.92 45.78 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.405 0.621 . . . . 0.0 110.648 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 52.5 mp0 -61.62 -41.71 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.424 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -46.08 -57.04 4.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.173 0.511 . . . . 0.0 110.494 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.5 mt -59.79 -35.38 74.55 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.867 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -64.55 -39.35 93.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.394 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.36 -46.87 88.41 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.14 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 3.9 mm? -59.77 -41.82 91.91 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.46 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 29.1 t-105 -59.92 -43.41 94.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 0.0 110.401 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -57.9 -41.98 83.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.206 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -61.25 -41.58 97.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.39 95.17 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.324 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.473 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 76.6 mt-30 -62.39 -38.4 89.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.32 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.527 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 42.0 mt -65.27 -38.37 90.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.446 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.35 109.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.3 mt -134.42 154.9 80.07 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -37.91 154.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.816 2.344 . . . . 0.0 112.202 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.95 -47.02 2.73 Favored 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.736 2.29 . . . . 0.0 112.551 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.432 HG23 ' N ' ' A' ' 41' ' ' ARG . 5.6 m -61.31 -47.18 94.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.452 -179.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.432 ' N ' HG23 ' A' ' 40' ' ' VAL . 61.4 ttm-85 -64.9 -40.64 95.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.434 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.14 -43.92 97.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.58 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -42.69 97.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.514 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -66.19 -47.09 75.06 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.618 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.01 -47.75 85.0 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.374 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -59.24 -41.25 88.3 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.293 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.415 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.55 -44.46 93.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.391 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -58.4 -45.79 87.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.137 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.1 mt -58.51 -41.49 85.53 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.178 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -59.15 -39.84 83.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.062 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 47' ' ' ALA . 3.0 mm -63.09 -43.02 98.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.858 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -56.4 -47.49 78.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.263 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -61.32 -44.36 97.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.107 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -60.02 -45.49 92.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.577 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.563 ' OD2' HD21 ' A' ' 77' ' ' LEU . 43.7 t0 -63.1 -37.83 88.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.655 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.0 -49.52 77.11 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.274 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.3 tp -59.44 -41.15 88.93 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.19 0.519 . . . . 0.0 110.163 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.56 -50.97 71.37 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.568 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.409 ' O ' ' HG ' ' A' ' 62' ' ' LEU . 70.5 t90 -57.82 -38.86 76.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.423 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -57.1 -45.77 83.13 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -60.59 -48.93 79.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.178 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.8 HD12 ' C ' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.03 -35.65 80.93 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.025 -0.67 . . . . 0.0 109.641 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.447 ' N ' ' HG ' ' A' ' 62' ' ' LEU . 29.3 tptp -61.26 -41.26 96.62 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 34.9 tp -60.19 -43.26 96.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.734 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -66.74 -35.35 79.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.999 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.3 67.49 1.36 Allowed Glycine 0 CA--C 1.52 0.365 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.618 ' O ' ' O ' ' A' ' 68' ' ' ASP . 99.1 mt -130.54 -86.99 0.51 Allowed 'General case' 0 N--CA 1.461 0.092 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.628 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.69 ' H ' HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER 53.15 141.55 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.438 179.579 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.528 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 83.5 tt0 -62.39 -51.98 65.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.868 0.366 . . . . 0.0 110.711 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 39.7 p30 -175.25 24.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.694 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.614 ' H ' ' CG ' ' A' ' 68' ' ' ASP . . . 89.34 -0.95 81.69 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -66.2 -32.67 74.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.713 0.292 . . . . 0.0 110.343 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.63 -49.45 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.268 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -62.33 -44.0 97.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.359 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.31 90.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.452 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -62.6 -42.45 99.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.911 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.563 HD21 ' OD2' ' A' ' 55' ' ' ASP . 84.5 mt -62.85 -44.57 95.77 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.057 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.65 -47.36 91.57 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.266 0.555 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.603 ' O ' HG23 ' A' ' 83' ' ' VAL . 60.8 ttp180 -61.35 -40.89 95.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.049 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -60.7 -41.2 94.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.373 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.654 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -60.21 -47.43 85.98 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.253 0.549 . . . . 0.0 110.049 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 28.6 t-20 -67.42 -37.53 83.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.56 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 79' ' ' ARG . 43.5 t -62.43 -48.27 89.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.441 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -61.44 -48.33 89.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.536 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.99 -42.19 97.26 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.85 87.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.348 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -61.76 -47.29 85.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.497 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -76.12 -21.14 56.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.439 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 71.98 27.51 70.33 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 90' ' ' LEU . 41.6 mt -86.98 -1.45 57.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.662 0.267 . . . . 0.0 110.592 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.412 ' OD1' ' C ' ' A' ' 91' ' ' ASP . 59.3 t0 -60.78 -83.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.192 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 154.93 -167.39 32.72 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.092 -0.575 . . . . 0.0 111.797 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 94' ' ' LYS . 46.7 mttt -99.79 -176.61 3.31 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 93' ' ' LYS . 52.2 mttp 57.03 120.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.766 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -154.8 166.45 33.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.527 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 44.64 92.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.622 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.418 ' H ' ' HG2' ' A' ' 97' ' ' ARG . 60.2 mmt-85 -63.91 -44.85 91.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.851 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -179.67 -78.42 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.76 0.314 . . . . 0.0 110.638 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.632 HG12 ' H ' ' A' ' 100' ' ' THR . 0.8 OUTLIER 41.37 -155.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.92 0.39 . . . . 0.0 110.89 179.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.752 HG23 ' H ' ' A' ' 101' ' ' SER . 0.4 OUTLIER -156.94 -98.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.499 -179.903 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.752 ' H ' HG23 ' A' ' 100' ' ' THR . 45.6 p -141.58 167.86 21.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.464 ' CG ' ' O ' ' A' ' 101' ' ' SER . 13.3 p30 47.18 -167.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.529 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.516 ' C ' HD22 ' A' ' 104' ' ' LEU . 47.0 t -137.56 145.62 43.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.516 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.516 HD22 ' C ' ' A' ' 103' ' ' SER . 3.4 mm? -106.0 131.11 53.68 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.292 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 91.5 p -158.11 163.23 37.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.63 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 93.24 50.73 2.35 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 92.7 m -62.01 -45.03 95.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.684 0.278 . . . . 0.0 110.852 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -88.23 103.1 15.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.468 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 111' ' ' GLY . 70.0 mm-40 -70.67 -41.79 71.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.791 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 65.4 t0 49.17 -86.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.611 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 109' ' ' GLU . . . -154.13 -59.52 0.01 OUTLIER Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.721 -0.951 . . . . 0.0 110.721 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.929 HD22 ' N ' ' A' ' 112' ' ' LEU . 0.8 OUTLIER -89.22 127.38 35.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.736 0.303 . . . . 0.0 110.343 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -101.32 -42.9 6.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.7 -179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.411 ' HB2' HD13 ' A' ' 117' ' ' LEU . 3.3 m-20 -96.39 147.94 33.71 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.406 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.35 -30.54 29.95 Favored 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 122.646 2.231 . . . . 0.0 112.239 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 68.3 mtp85 -64.3 -43.62 94.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.881 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.578 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.0 mp -63.58 -38.89 92.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.714 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.605 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 99.1 mt-10 -56.17 -31.34 63.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.071 0.462 . . . . 0.0 110.444 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.593 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 99.6 mttt -64.66 -48.12 75.95 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.533 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 120' ' ' LEU . 50.7 mt -71.42 -45.83 61.71 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.983 0.42 . . . . 0.0 111.889 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.579 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.4 t-105 -58.67 -48.69 80.23 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.605 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.2 m-70 -69.87 -32.59 71.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.378 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 13.1 tptt -59.31 -48.55 81.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.733 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.98 -47.61 65.16 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.696 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -57.23 -49.51 75.79 Favored 'General case' 0 C--O 1.23 0.04 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.121 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 5.2 m -74.91 -46.43 36.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.74 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 41.7 p -45.85 -29.26 1.3 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.122 -178.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 129' ' ' LYS . . . -155.72 -95.63 0.11 Allowed Glycine 0 N--CA 1.463 0.489 0 C-N-CA 119.928 -1.129 . . . . 0.0 111.173 179.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.597 ' O ' ' N ' ' A' ' 131' ' ' SER . 26.9 mttm -163.86 27.87 0.08 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.492 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.6 m-30 -63.5 44.58 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.651 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.597 ' N ' ' O ' ' A' ' 129' ' ' LYS . 9.5 p -100.95 112.4 24.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.436 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 124.98 -97.12 0.53 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.076 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 134' ' ' GLU . 12.7 pt-20 -78.17 -42.88 30.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.854 0.359 . . . . 0.0 110.841 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.492 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 53.0 mp0 -60.63 -53.56 55.98 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.948 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.579 HD22 ' CE3' ' A' ' 121' ' ' TRP . 2.8 mt -61.84 -41.18 97.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.175 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -60.0 -44.53 94.49 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.085 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -59.61 -43.84 93.62 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.0 mm? -59.31 -42.53 91.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.293 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.532 ' CZ3' ' CE2' ' A' ' 142' ' ' PHE . 0.4 OUTLIER -64.94 -37.82 88.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.42 -0.809 . . . . 0.0 113.027 176.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 94.5 mtt180 -52.37 -43.72 64.85 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.64 -40.1 76.72 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.776 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.532 ' CE2' ' CZ3' ' A' ' 139' ' ' TRP . 3.2 m-85 -58.36 -55.22 37.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.33 -179.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 59.9 mt -59.66 -38.48 81.57 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.22 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.428 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 54.0 m170 -54.1 -47.66 71.53 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.848 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -61.71 -39.19 90.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -60.34 -41.98 94.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.26 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -65.01 -55.17 20.52 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.823 0.344 . . . . 0.0 111.297 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.43 -45.22 94.08 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.987 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.468 HG22 HD13 ' A' ' 197' ' ' ILE . 51.5 t -64.1 -35.5 73.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.949 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.789 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -66.1 -41.75 90.2 Favored 'General case' 0 C--O 1.209 -1.042 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.014 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.9 -43.65 98.24 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.091 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.49 ' CD1' ' CE ' ' A' ' 193' ' ' LYS . 17.1 m-85 -70.5 -46.45 63.67 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.544 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . 0.46 ' ND2' ' CG1' ' A' ' 149' ' ' VAL . 89.5 m-20 -67.55 -42.59 82.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.59 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 150' ' ' HIS . 76.2 t -61.54 -47.05 95.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.034 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 155' ' ' LEU . 46.5 mt -64.12 -44.58 91.8 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.62 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.666 HD21 HD21 ' A' ' 190' ' ' LEU . 19.5 mt -63.75 -43.54 96.15 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.659 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.473 ' HA ' ' OG ' ' A' ' 160' ' ' SER . 69.3 mm-40 -65.65 -31.88 73.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.154 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 66.6 m -65.57 -49.15 69.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.722 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 pp -79.13 -21.13 46.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.514 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.473 ' OG ' ' HA ' ' A' ' 157' ' ' GLU . 93.2 p -66.89 -20.7 65.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.436 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -59.2 -42.01 89.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.911 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.81 31.57 0.61 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.633 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -137.15 -40.14 0.59 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.991 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 67.3 tt0 -92.38 24.51 3.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.971 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.452 HG13 ' N ' ' A' ' 166' ' ' HIS . 8.8 tp -55.5 155.23 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.466 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.452 ' N ' HG13 ' A' ' 165' ' ' ILE . 40.2 m80 -112.94 62.87 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.026 0.441 . . . . 0.0 110.015 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.17 26.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.514 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -167.27 118.55 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.453 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . 0.47 ' O ' HG12 ' A' ' 169' ' ' VAL . 4.7 t -118.96 25.0 4.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 9.9 tp -145.01 136.65 20.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.756 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.08 156.4 69.48 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.528 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.22 -5.59 16.38 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.823 2.349 . . . . 0.0 112.082 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 30.6 t -45.66 132.9 8.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.612 -179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -170.57 52.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.431 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.474 ' O ' ' OG ' ' A' ' 176' ' ' SER . 64.3 mt -105.8 38.45 2.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.619 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.474 ' OG ' ' O ' ' A' ' 175' ' ' LEU . 90.5 p 53.86 56.71 6.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.345 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 23.2 t0 54.79 30.02 12.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.525 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 24.1 mm 48.34 91.52 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.716 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -66.09 -40.64 90.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.532 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 148.06 0.02 0.58 Allowed Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 9.8 t -64.61 -43.08 94.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.015 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.648 HG12 ' N ' ' A' ' 183' ' ' LEU . 24.2 t -132.65 168.91 23.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.695 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.648 ' N ' HG12 ' A' ' 182' ' ' VAL . 3.1 mt 64.74 -16.37 0.09 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.879 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.594 ' H ' ' C ' ' A' ' 182' ' ' VAL . 0.4 OUTLIER -58.25 -41.1 83.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.531 -179.814 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.582 ' H ' ' CD2' ' A' ' 184' ' ' HIS . 11.4 t -61.56 -44.32 97.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.153 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.704 ' O ' HD13 ' A' ' 190' ' ' LEU . 79.3 mtp85 -61.75 -44.79 96.2 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.806 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -67.57 -38.36 83.98 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.386 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.1 m -63.19 -44.44 95.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.338 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.1 -44.9 90.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.354 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 186' ' ' ARG . 8.1 mp -62.83 -42.64 99.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.691 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.505 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 68.1 mttm -67.97 -34.2 76.09 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.935 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.544 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 79.6 tt0 -67.69 -47.6 68.97 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.218 0.532 . . . . 0.0 111.362 -178.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.49 ' CE ' ' CD1' ' A' ' 152' ' ' TYR . 12.4 ptmt -73.28 -40.64 64.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.44 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.822 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.9 -40.29 75.72 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.818 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.687 ' NH1' HE22 ' A' ' 199' ' ' GLN . 3.4 ppt_? -65.6 -37.56 86.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 89.6 p -62.67 -43.88 97.68 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.468 HD13 HG22 ' A' ' 149' ' ' VAL . 96.8 mt -65.86 -43.34 93.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.782 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -60.87 -40.93 94.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.361 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.687 HE22 ' NH1' ' A' ' 195' ' ' ARG . 31.8 mt-30 -63.08 -38.56 91.66 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.576 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -60.76 -43.89 98.6 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 204' ' ' LEU . 18.9 mt -64.39 -39.04 93.09 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.01 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -59.76 -39.96 86.57 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.498 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 6.4 tmm_? -63.1 -42.68 99.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.393 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 201' ' ' LEU . 43.6 mt -61.86 -40.62 96.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.396 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -61.44 -41.68 97.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.749 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.704 ' O ' ' N ' ' A' ' 210' ' ' GLN . 81.1 mtp180 -62.3 -40.84 97.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.365 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.609 ' O ' ' N ' ' A' ' 211' ' ' GLY . 43.0 t -63.52 -46.09 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.083 0.468 . . . . 0.0 110.313 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.7 p -69.84 -26.65 64.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.508 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 41.1 m170 -101.81 -14.49 17.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.147 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 206' ' ' ARG . 64.1 tp60 -132.27 -37.84 1.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.765 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.609 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -52.86 -14.39 2.64 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.482 ' O ' ' N ' ' A' ' 214' ' ' THR . 2.7 m-85 -59.53 145.7 43.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.954 0.407 . . . . 0.0 110.688 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 27.4 t -50.39 89.58 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.348 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.482 ' N ' ' O ' ' A' ' 212' ' ' TYR . 24.4 p -124.13 10.1 8.72 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.888 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 65.09 103.73 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.067 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . 179.19 86.18 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.302 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -143.7 35.93 1.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.018 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.553 ' O ' ' HB3' ' A' ' 219' ' ' GLU . 4.3 m-85 -65.04 152.24 43.94 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 110.469 -0.196 . . . . 0.0 110.469 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.553 ' HB3' ' O ' ' A' ' 218' ' ' PHE . 83.3 tt0 74.61 -19.79 0.36 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 178.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 221' ' ' PRO . 32.4 mm-40 -89.65 150.95 45.16 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.615 ' O ' ' HB3' ' A' ' 222' ' ' ARG . 51.1 Cg_exo -51.54 -155.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.771 2.314 . . . . 0.0 111.874 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 221' ' ' PRO . 41.5 ttm180 87.62 -102.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.71 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.552 HG13 ' N ' ' A' ' 224' ' ' ILE . 14.4 p -59.15 -44.95 92.89 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 110.636 -179.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.552 ' N ' HG13 ' A' ' 223' ' ' VAL . 4.1 mm -61.6 -41.14 89.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.075 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -60.98 -39.65 90.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.91 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 7.7 mt -59.71 -41.81 91.64 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.28 0.562 . . . . 0.0 109.769 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.55 ' CZ3' HD13 ' A' ' 224' ' ' ILE . 54.8 m0 -61.42 -43.04 99.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.916 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.56 -25.52 65.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 232' ' ' SER . 2.8 mt -65.39 -43.33 91.02 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.93 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.438 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -34.8 -44.22 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.794 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.403 ' HB2' HE21 ' A' ' 231' ' ' GLN . 6.8 tt0 -62.6 -47.91 81.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.652 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.547 ' O ' ' O ' ' A' ' 233' ' ' ALA . 35.7 t -67.6 -40.02 84.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.565 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . 0.547 ' O ' ' O ' ' A' ' 232' ' ' SER . . . -47.93 -111.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.732 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -157.43 111.72 2.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . . . . . . . . . 78.2 mt -146.36 161.64 39.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.579 ' OG1' ' HG2' ' A' ' 239' ' ' GLU . 0.0 OUTLIER -83.1 165.43 19.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.686 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -60.65 -47.38 86.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.991 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.1 -47.43 85.31 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 110.552 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.579 ' HG2' ' OG1' ' A' ' 236' ' ' THR . 5.7 mm-40 -66.3 -35.77 81.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.002 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.798 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -63.11 -43.31 98.79 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.206 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -63.01 -48.99 76.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.398 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.69 -44.18 97.43 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.344 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.585 ' HB2' ' HE ' ' A' ' 319' ' ' ARG . 0.6 OUTLIER -62.41 -43.87 97.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.122 179.062 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -59.37 -46.69 87.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.047 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -66.19 -44.07 85.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.706 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -59.66 -49.59 77.14 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.597 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.6 mm? -62.65 -38.32 89.84 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.525 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.41 -41.14 84.27 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.829 0.347 . . . . 0.0 110.071 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -66.51 -61.01 2.21 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.555 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . 0.434 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 25.3 t80 -59.58 -45.76 90.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.511 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.6 tp10 -54.88 -38.51 67.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.163 0.506 . . . . 0.0 109.701 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.31 82.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.244 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -60.72 -47.94 84.03 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.857 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.469 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 2.6 tp -63.49 -37.39 79.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.126 179.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -59.66 -44.02 93.72 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 121.07 0.462 . . . . 0.0 109.888 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -63.27 -42.41 99.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.134 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . 0.495 ' NE2' HG22 ' A' ' 297' ' ' THR . 15.5 t-80 -56.93 -42.43 80.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.159 0.504 . . . . 0.0 110.127 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -63.24 -40.0 96.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.084 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . 0.456 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -58.35 -46.58 86.0 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.147 0.499 . . . . 0.0 110.338 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -62.98 -35.68 80.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.201 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.48 ' NE2' HG21 ' A' ' 297' ' ' THR . 32.8 mm-40 -60.48 -45.02 95.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.117 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -62.05 -43.76 98.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.209 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . 0.456 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 7.8 mp0 -66.92 -37.86 85.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.203 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . 0.891 HD21 ' OE1' ' A' ' 294' ' ' GLU . 53.9 tp -62.39 -43.54 98.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.294 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -66.21 -45.39 80.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.429 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 51.8 mt -62.94 -43.22 98.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.243 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.68 -37.82 82.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.253 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.77 -45.49 86.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.446 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -62.81 -46.44 87.96 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.618 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 60.5 tptt -60.48 -42.08 95.52 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.658 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.644 HD13 ' CB ' ' A' ' 286' ' ' SER . 35.4 tp -61.78 -43.15 99.43 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.27 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -58.13 -42.81 86.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.176 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -73.56 -33.71 64.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.506 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.744 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -64.04 -40.78 97.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.656 -179.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -54.26 -18.9 4.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.892 0.377 . . . . 0.0 110.594 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 4.1 t -62.32 -32.86 73.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.636 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.744 HG12 ' O ' ' A' ' 274' ' ' ALA . 10.4 p -58.67 -45.16 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.421 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.585 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 79.0 -10.26 34.42 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . 0.547 ' H ' HG13 ' A' ' 277' ' ' VAL . 54.1 m-20 -61.78 -38.6 88.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.661 0.267 . . . . 0.0 110.549 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . 0.661 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 98.11 -146.49 18.22 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . 0.458 ' OE1' ' C ' ' A' ' 280' ' ' GLY . 51.5 mp0 57.97 -65.03 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 110.778 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . 0.661 ' N ' ' O ' ' A' ' 280' ' ' GLY . 99.7 mtt180 -63.33 -37.97 89.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.665 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.81 -46.74 95.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.518 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . 0.451 ' O ' ' OE1' ' A' ' 288' ' ' GLU . 12.0 t -63.1 -47.44 82.84 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.052 0.454 . . . . 0.0 110.933 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 73.3 ttp85 -64.11 -42.99 96.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.82 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . 0.644 ' CB ' HD13 ' A' ' 271' ' ' LEU . 42.1 t -60.28 -43.79 95.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.453 -179.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . 0.636 ' NH2' ' CG ' ' A' ' 290' ' ' HIS . 5.5 mmp_? -64.12 -37.74 88.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.06 0.457 . . . . 0.0 110.677 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . 0.451 ' OE1' ' O ' ' A' ' 284' ' ' SER . 0.4 OUTLIER -60.22 -56.38 22.21 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.324 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.447 ' HD3' HD23 ' A' ' 292' ' ' LEU . 28.3 mmtt -65.57 -34.94 79.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.979 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . 0.636 ' CG ' ' NH2' ' A' ' 287' ' ' ARG . 42.8 t-80 -51.84 -48.68 63.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.66 -37.01 79.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.541 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.447 HD23 ' HD3' ' A' ' 289' ' ' LYS . 14.6 tp -62.2 -49.93 73.79 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.555 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . 0.463 ' O ' ' OG1' ' A' ' 297' ' ' THR . 10.4 mp -62.91 -41.33 99.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.134 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.891 ' OE1' HD21 ' A' ' 264' ' ' LEU . 29.5 tp10 -62.99 -41.25 99.52 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -59.51 -48.22 87.08 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.15 -40.23 89.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 0.0 110.231 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.495 HG22 ' NE2' ' A' ' 257' ' ' HIS . 0.2 OUTLIER -56.84 -47.48 80.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.105 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -63.12 -42.41 99.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.452 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.73 -47.55 76.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.479 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . 0.422 ' HA ' HD13 ' A' ' 300' ' ' LEU . 0.5 OUTLIER -60.24 -43.44 96.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.512 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.82 -42.02 84.8 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . 0.602 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 53.5 t80 -62.66 -46.62 87.34 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.422 0.629 . . . . 0.0 110.587 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . 0.417 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 15.7 m -61.69 -45.93 91.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.454 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.51 -30.74 50.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.203 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -62.6 -55.04 30.87 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 121.141 0.496 . . . . 0.0 110.516 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . 0.602 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 77.5 mttt -62.17 -42.67 99.49 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.81 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.417 ' ND1' ' O ' ' A' ' 303' ' ' THR . 60.2 m80 -63.9 -32.01 73.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.988 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.425 HD23 ' CH2' ' A' ' 227' ' ' TRP . 1.6 mt -62.75 -48.44 79.19 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -66.84 -41.1 87.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.697 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -62.08 -49.12 77.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.793 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.453 ' HA ' HD23 ' A' ' 311' ' ' LEU . 26.6 mt -63.51 -40.58 97.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.029 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 6.7 t -60.02 -44.31 94.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.29 -44.86 84.31 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.705 ' N ' ' HE ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -65.84 -43.61 87.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.877 0.37 . . . . 0.0 111.114 -179.599 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.3 mm -69.76 -24.02 26.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.881 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 67.7 m -59.14 -43.13 92.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.204 0.526 . . . . 0.0 110.057 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.86 -2.66 34.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.251 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.741 ' O ' HD21 ' A' ' 323' ' ' LEU . . . 61.62 -141.84 0.46 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.524 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.585 ' HE ' ' HB2' ' A' ' 243' ' ' PHE . 1.5 mpt_? -108.7 -82.08 0.56 Allowed 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.407 -178.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 74.2 -11.27 1.01 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.032 0.444 . . . . 0.0 110.595 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.425 ' H ' ' C ' ' A' ' 319' ' ' ARG . 0.2 OUTLIER -176.85 35.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.516 ' CA ' ' OE1' ' A' ' 239' ' ' GLU . 81.4 tt0 56.74 154.19 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.543 -178.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.741 HD21 ' O ' ' A' ' 318' ' ' ALA . 5.3 mt . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 117.866 -1.064 . . . . 0.0 110.599 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 93.8 p -75.51 171.1 14.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.522 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.469 ' HD3' HH11 ' A' ' 3' ' ' ARG . 42.7 ttp-105 65.23 125.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.575 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -132.66 156.65 46.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.147 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -111.14 138.99 46.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.622 -179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.422 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 17.5 p30 -160.78 128.71 4.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.541 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.422 ' NE2' ' H ' ' A' ' 6' ' ' ASN . 25.5 mp0 -141.94 60.68 11.37 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.899 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' O ' ' CB ' ' A' ' 9' ' ' LYS . 72.3 Cg_endo -75.11 149.57 36.46 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 123.028 2.485 . . . . 0.0 112.391 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.439 ' CB ' ' O ' ' A' ' 8' ' ' PRO . 23.0 tttp 164.88 130.42 0.03 OUTLIER Pre-proline 0 CA--C 1.534 0.335 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.353 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.33 155.29 60.57 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 122.373 2.049 . . . . 0.0 111.802 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.8 p -89.14 130.53 43.92 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.858 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -76.2 -18.64 16.09 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.864 2.376 . . . . 0.0 112.028 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -85.01 159.4 20.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.592 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -129.24 148.68 51.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.278 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -119.2 124.58 47.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.62 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.9 t -156.9 152.69 27.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.518 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -94.51 -172.61 38.15 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.834 -0.907 . . . . 0.0 110.834 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -108.72 124.7 50.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.717 0.294 . . . . 0.0 110.331 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -79.64 -12.65 59.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.733 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -132.13 167.22 20.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.777 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -61.19 -40.34 93.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 88.8 mmm -121.25 149.08 43.4 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.418 0.627 . . . . 0.0 111.074 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 23' ' ' GLU . 4.2 pm0 -61.58 -40.33 94.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.435 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -52.31 -48.79 65.2 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.179 0.514 . . . . 0.0 110.668 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.81 -39.47 91.87 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.359 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.9 t-20 -62.91 -38.82 92.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.189 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -61.74 -43.52 98.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.354 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.29 -42.68 99.06 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -61.16 -47.14 87.56 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.234 0.54 . . . . 0.0 110.44 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -57.51 -41.99 81.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.295 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -61.23 -43.1 99.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.238 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.87 88.11 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.071 0.462 . . . . 0.0 110.082 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.646 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 24.5 mt-30 -59.41 -39.31 83.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.173 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.603 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 61.6 ttt85 -60.96 -39.88 91.24 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.373 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.67 -34.53 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.296 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.646 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 24.9 m80 66.41 118.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.5 mt -137.13 154.61 75.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.115 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 79.4 Cg_exo -41.74 154.62 0.09 OUTLIER 'Trans proline' 0 C--N 1.312 -1.354 0 C-N-CA 122.504 2.136 . . . . 0.0 112.41 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 34.1 Cg_exo -56.5 -47.49 23.69 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.511 2.141 . . . . 0.0 112.375 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.8 -45.71 94.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.447 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpt180 -62.52 -41.89 99.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.58 -43.61 98.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.715 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.26 89.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.595 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -68.67 -42.38 77.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.528 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.729 HD13 ' OH ' ' A' ' 88' ' ' TYR . 50.9 tp -63.04 -48.67 77.74 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.23 0.538 . . . . 0.0 110.661 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -59.96 -42.77 94.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.25 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.615 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.33 -46.56 88.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.607 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -55.8 -47.78 76.53 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.485 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.0 -40.74 85.82 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.139 0.495 . . . . 0.0 109.988 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.49 -39.14 82.77 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.947 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 47' ' ' ALA . 35.9 mm -62.83 -42.71 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.59 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -55.79 -46.79 77.89 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.444 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -60.06 -50.48 73.56 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.355 0.597 . . . . 0.0 110.419 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.313 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -61.21 -40.57 94.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.385 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.18 -51.02 67.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.05 -39.65 93.09 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.242 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.5 92.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.63 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.459 ' CZ3' ' HD3' ' A' ' 63' ' ' LYS . 89.3 t90 -61.87 -40.26 94.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.267 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.76 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 87.8 tttt -57.61 -49.33 76.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.463 0.649 . . . . 0.0 109.556 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -66.46 -41.27 89.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.182 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.46 -44.16 97.59 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.618 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.76 ' HG2' ' O ' ' A' ' 60' ' ' LYS . 18.4 pttm -61.93 -39.19 91.19 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 63' ' ' LYS . 56.5 tp -58.63 -44.09 89.93 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.509 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -64.87 -37.64 88.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.191 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 92.13 56.95 1.53 Allowed Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 95.5 mt -116.83 -10.44 11.04 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.798 0.332 . . . . 0.0 110.76 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.549 ' OD2' ' N ' ' A' ' 71' ' ' GLY . 5.1 t70 -77.57 121.9 24.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.243 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.441 ' OE1' ' OE2' ' A' ' 72' ' ' GLU . 94.1 mt-10 -49.87 -85.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.793 -179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -131.32 42.78 3.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.795 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.549 ' N ' ' OD2' ' A' ' 68' ' ' ASP . . . 80.3 18.48 71.44 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.441 ' OE2' ' OE1' ' A' ' 69' ' ' GLU . 96.0 mt-10 -60.61 -35.03 75.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.796 0.331 . . . . 0.0 110.361 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -62.07 -48.32 80.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.23 0.538 . . . . 0.0 110.003 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.37 -39.32 90.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.252 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.41 94.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.208 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -63.66 -39.74 95.1 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.466 -0.493 . . . . 0.0 109.754 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.7 mt -62.62 -45.23 93.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.431 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.24 -44.58 95.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.056 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.755 ' O ' HG23 ' A' ' 83' ' ' VAL . 63.3 ttm-85 -58.1 -42.63 86.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.885 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.428 ' O ' HG13 ' A' ' 84' ' ' ILE . 11.5 m120 -62.72 -39.62 94.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.308 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.59 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -57.78 -49.63 75.96 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.96 -179.359 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.446 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 53.9 t-20 -64.68 -37.37 87.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.336 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 79' ' ' ARG . 72.7 t -63.16 -45.8 97.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.466 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.17 -50.34 80.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.061 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 3.6 mm? -65.44 -39.77 92.47 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.769 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.84 -45.23 95.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.65 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -62.83 -45.87 90.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.849 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.729 ' OH ' HD13 ' A' ' 45' ' ' LEU . 8.7 m-85 -64.44 -28.04 69.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.297 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.18 23.29 61.45 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.7 mt -93.8 2.32 56.24 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.8 0.333 . . . . 0.0 110.398 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -84.87 -1.95 57.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.572 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -59.58 163.38 13.44 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.289 -0.725 . . . . 0.0 111.289 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -133.21 170.84 14.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.752 0.31 . . . . 0.0 110.755 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.531 ' O ' ' O ' ' A' ' 95' ' ' ASP . 99.2 mttt -56.13 -76.53 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.636 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.634 ' O ' ' N ' ' A' ' 97' ' ' ARG . 37.6 t70 55.91 137.42 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.69 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 58.15 -68.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.456 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.634 ' N ' ' O ' ' A' ' 95' ' ' ASP . 70.8 ttt180 58.62 154.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.446 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.1 142.36 56.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.184 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 34.8 m -129.21 157.73 41.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.23 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.427 ' O ' ' ND2' ' A' ' 102' ' ' ASN . 27.1 m -63.53 134.32 55.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.033 -179.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 20.8 p -60.11 142.85 53.52 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.324 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.427 ' ND2' ' O ' ' A' ' 100' ' ' THR . 70.7 m-80 -159.44 35.76 0.2 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.672 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 79.7 p -69.57 -12.54 61.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.45 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.59 -39.81 92.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.681 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 39.4 t -58.07 -43.36 86.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.391 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 79.9 -94.0 1.42 Allowed Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 92.8 m -118.79 129.09 55.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.921 0.391 . . . . 0.0 110.482 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -135.97 74.77 1.52 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.521 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -157.54 113.42 2.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.506 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.464 ' OD1' ' O ' ' A' ' 110' ' ' ASP . 51.3 p-10 -151.86 88.5 1.4 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.511 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.85 ' HA3' ' NE2' ' A' ' 122' ' ' HIS . . . -64.24 -41.81 98.13 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 37.6 tp -160.31 -84.29 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.648 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -163.56 -65.27 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.661 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.94 128.02 77.89 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.434 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.436 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 50.3 Cg_exo -51.19 -39.54 61.54 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 122.422 2.081 . . . . 0.0 112.502 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 82.5 mtm180 -61.03 -45.44 94.76 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.984 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.1 mt -68.33 -40.14 81.71 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.234 0.54 . . . . 0.0 110.664 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.56 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 96.8 mt-10 -58.81 -33.18 70.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.333 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 56.6 mttp -60.8 -47.97 83.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.712 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.19 -45.82 86.65 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.206 0.527 . . . . 0.0 111.928 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.487 ' CE3' HD22 ' A' ' 135' ' ' LEU . 14.3 t-105 -60.86 -51.5 69.05 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.975 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.85 ' NE2' ' HA3' ' A' ' 111' ' ' GLY . 9.7 m-70 -68.88 -29.32 67.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.234 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.634 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.1 tptt -57.6 -49.97 74.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.452 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.404 ' HB1' ' CB ' ' A' ' 130' ' ' PHE . . . -71.68 -47.56 53.33 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 119.3 -0.96 . . . . 0.0 111.022 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.427 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 38.3 ttmt -53.21 -48.47 68.1 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.875 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 10.5 m -78.91 -43.28 25.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.897 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.589 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 18.0 m -44.73 -28.49 0.63 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -163.87 -96.03 0.11 Allowed Glycine 0 C--N 1.321 -0.259 0 C-N-CA 119.684 -1.246 . . . . 0.0 111.576 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.702 ' O ' ' N ' ' A' ' 131' ' ' SER . 97.7 mttt -152.02 20.5 0.68 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.46 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 2.6 m-85 -59.53 41.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.613 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.798 ' HA ' HD12 ' A' ' 135' ' ' LEU . 5.5 p -103.0 114.46 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.976 0.417 . . . . 0.0 111.247 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.502 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 120.92 -96.88 0.61 Allowed Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.788 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.47 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 79.7 mm-40 -72.97 -43.77 61.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.909 0.385 . . . . 0.0 111.342 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 130' ' ' PHE . 4.1 mp0 -65.52 -45.8 82.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.126 0.489 . . . . 0.0 110.165 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 131' ' ' SER . 1.7 mt -60.64 -41.9 95.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.898 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.502 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -63.01 -40.23 97.15 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.92 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -59.56 -44.36 93.3 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 121.273 0.558 . . . . 0.0 110.207 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.1 mm? -60.84 -42.52 97.94 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -30.67 70.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 176.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 136' ' ' ASP . 59.6 mmt-85 -59.02 -44.16 91.69 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.432 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -71.02 -39.44 72.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.859 179.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.27 -58.28 9.2 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.565 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 143' ' ' LEU . 93.9 mt -61.0 -39.29 89.12 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.218 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -55.25 -43.02 74.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.441 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.662 ' CE1' HG23 ' A' ' 197' ' ' ILE . 7.7 m-70 -64.84 -38.23 90.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -59.64 -45.03 93.2 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.403 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -70.48 -51.74 26.91 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.739 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.442 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 14.5 mptt -62.54 -44.51 96.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.157 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 2.6 p -63.77 -35.95 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.501 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.776 ' O ' HG23 ' A' ' 154' ' ' VAL . 1.9 m170 -66.01 -43.23 88.32 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.665 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.99 -44.7 96.18 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.364 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.442 ' CD2' ' O ' ' A' ' 148' ' ' LYS . 31.4 m-85 -69.58 -46.76 65.61 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.904 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -65.59 -41.07 93.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.103 0.478 . . . . 0.0 110.527 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 150' ' ' HIS . 63.8 t -63.08 -43.92 99.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.674 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 44.7 mt -62.66 -44.24 96.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.561 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 15.7 mt -63.74 -42.68 97.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.699 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -68.81 -25.52 64.72 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.933 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 58.5 m -70.63 -47.43 60.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.852 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.9 pp -78.72 -24.44 44.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.621 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 97.6 p -60.81 -42.93 98.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.69 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -64.42 -43.29 94.83 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 -179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 3.1 m -85.2 38.91 0.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.501 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -126.62 -27.14 3.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.0 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -100.75 23.07 11.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.339 0.59 . . . . 0.0 110.105 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.6 tt -57.15 136.99 19.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.741 178.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.648 ' C ' ' H ' ' A' ' 168' ' ' ASN . 35.6 m170 -135.79 26.01 3.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.05 0.453 . . . . 0.0 109.98 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.498 ' O ' ' HG2' ' A' ' 167' ' ' GLU . 78.5 tt0 -65.02 25.54 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.393 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.648 ' H ' ' C ' ' A' ' 166' ' ' HIS . 29.1 p30 -174.39 -165.93 0.24 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.453 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 6.3 p -81.23 135.34 25.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.437 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.408 ' O ' HG23 ' A' ' 170' ' ' ILE . 20.1 tt -85.74 133.71 28.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.53 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . 0.619 ' O ' ' N ' ' A' ' 173' ' ' SER . 0.0 OUTLIER -139.44 161.55 56.42 Favored Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.211 179.868 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -46.98 75.02 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 122.812 2.342 . . . . 0.0 112.263 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.619 ' N ' ' O ' ' A' ' 171' ' ' SER . 87.6 p -163.6 159.32 21.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.685 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -123.29 -9.96 8.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.343 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.562 ' O ' ' N ' ' A' ' 177' ' ' ASP . 4.0 tp -157.08 169.23 25.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.4 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.503 ' H ' ' HG ' ' A' ' 175' ' ' LEU . 38.1 t -60.15 72.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.29 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.562 ' N ' ' O ' ' A' ' 175' ' ' LEU . 52.8 t0 48.99 106.14 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.832 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 3.3 pt -130.96 133.06 63.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.765 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -98.29 19.45 14.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.351 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 91.44 32.24 8.9 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 37.4 m -62.16 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.835 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.604 ' O ' ' N ' ' A' ' 184' ' ' HIS . 4.3 t -142.09 -130.38 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.543 -179.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.593 ' H ' HG12 ' A' ' 182' ' ' VAL . 4.9 tt 61.54 -49.65 0.13 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.838 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.604 ' N ' ' O ' ' A' ' 182' ' ' VAL . 15.4 p80 -58.71 -43.69 90.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.505 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.597 ' HG ' ' CE1' ' A' ' 184' ' ' HIS . 59.2 m -64.42 -41.78 96.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.544 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 75.3 mtm180 -64.44 -46.77 81.7 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.581 -0.448 . . . . 0.0 112.054 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . 0.647 ' C ' ' ND1' ' A' ' 187' ' ' HIS . 0.1 OUTLIER -71.97 -34.77 69.23 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.785 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . 0.627 ' N ' ' ND1' ' A' ' 187' ' ' HIS . 59.6 m -62.88 -46.13 89.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.82 179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 193' ' ' LYS . 75.7 mm-40 -62.49 -34.33 76.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.573 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 187' ' ' HIS . 21.1 mt -61.16 -41.62 97.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.932 0.396 . . . . 0.0 110.208 178.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.652 ' HA ' HD23 ' A' ' 194' ' ' LEU . 68.1 mttm -67.68 -35.92 79.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.815 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 79.8 mm-40 -67.06 -45.65 76.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.981 0.42 . . . . 0.0 111.492 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.543 ' HD3' ' HA ' ' A' ' 190' ' ' LEU . 4.5 ptmt -69.25 -36.54 77.25 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.936 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.826 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -62.53 -44.11 97.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.989 -179.521 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.533 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 16.0 ptm180 -65.78 -35.87 81.93 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.417 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.44 ' N ' ' HG3' ' A' ' 195' ' ' ARG . 72.4 m -59.5 -40.56 87.43 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.662 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.6 mt -63.76 -42.98 97.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.399 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -58.84 -41.99 88.24 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.61 -38.54 88.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.33 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -59.55 -41.68 97.36 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.213 -1.155 . . . . 0.0 110.213 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 204' ' ' LEU . 20.4 mt -61.94 -40.14 94.5 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.672 178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -62.04 -36.53 81.87 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.464 ' O ' ' HD3' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -62.45 -42.49 99.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.248 178.832 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 201' ' ' LEU . 32.4 mt -60.19 -39.36 86.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.451 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -60.44 -41.8 94.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.604 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.603 ' O ' ' N ' ' A' ' 210' ' ' GLN . 25.9 mmt85 -62.43 -38.62 90.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.117 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.591 ' O ' ' N ' ' A' ' 211' ' ' GLY . 30.4 t -63.64 -45.09 98.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.302 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -66.13 -28.17 68.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.471 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -94.64 -39.45 10.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.026 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.603 ' N ' ' O ' ' A' ' 206' ' ' ARG . 56.2 tt0 -96.16 -40.46 9.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.399 . . . . 0.0 110.715 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -84.16 30.58 3.61 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.524 ' CE1' ' OG ' ' A' ' 127' ' ' SER . 87.4 t80 -59.36 -48.29 82.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.66 0.267 . . . . 0.0 110.673 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.704 ' OG ' ' N ' ' A' ' 214' ' ' THR . 18.8 p -172.51 -85.39 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.676 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.704 ' N ' ' OG ' ' A' ' 213' ' ' SER . 0.5 OUTLIER 175.48 173.77 0.27 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.489 -179.681 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.569 ' OE1' ' N ' ' A' ' 215' ' ' GLU . 56.6 mp0 -112.9 179.99 3.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.446 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . 63.07 123.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.234 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -137.6 35.48 2.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.0 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.638 ' N ' ' HD1' ' A' ' 218' ' ' PHE . 0.0 OUTLIER -59.32 -14.74 12.62 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.369 -179.862 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.479 ' HG3' ' CE1' ' A' ' 218' ' ' PHE . 96.9 mt-10 -65.63 -41.01 93.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.623 ' C ' ' H ' ' A' ' 222' ' ' ARG . 7.3 mt-10 41.12 103.69 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.264 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.486 ' O ' ' CB ' ' A' ' 225' ' ' ASP . 32.1 Cg_exo -57.97 15.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 123.023 2.482 . . . . 0.0 112.243 177.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.623 ' H ' ' C ' ' A' ' 220' ' ' GLU . 84.8 mtt85 -112.66 -59.81 1.96 Allowed 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.853 0.359 . . . . 0.0 110.692 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.899 HG13 ' H ' ' A' ' 224' ' ' ILE . 6.2 p -65.37 -64.61 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-O 121.404 0.621 . . . . 0.0 111.326 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.899 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.4 OUTLIER -62.3 -32.39 54.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.721 -179.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 21.8 t70 -63.0 -40.74 98.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.303 0.573 . . . . 0.0 109.836 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.8 mt -61.42 -40.78 95.66 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.572 ' CH2' HD23 ' A' ' 308' ' ' LEU . 40.0 m0 -59.75 -38.28 81.33 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.059 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -63.22 -37.55 87.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.443 ' HA ' HD23 ' A' ' 229' ' ' LEU . 93.3 mt -63.96 -41.86 97.45 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.366 0.603 . . . . 0.0 110.199 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . . . . . . . . . . . -50.03 -14.88 0.17 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.835 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.578 ' O ' HD21 ' A' ' 240' ' ' LEU . 18.3 pt20 -64.82 -42.83 94.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.759 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.5 ' N ' ' CG ' ' A' ' 231' ' ' GLN . 23.7 m -136.95 58.03 1.74 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -109.28 45.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.403 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . 0.578 ' C ' HD22 ' A' ' 235' ' ' LEU . 50.2 t-20 65.84 53.38 1.15 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.998 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.578 HD22 ' C ' ' A' ' 234' ' ' ASN . 4.2 mm? -108.56 177.87 4.66 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.066 0.46 . . . . 0.0 110.447 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.477 ' OG1' ' CG ' ' A' ' 239' ' ' GLU . 60.6 p -84.57 -176.23 6.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.477 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -85.47 -50.78 7.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.202 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -62.01 -44.72 96.12 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.033 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.477 ' CG ' ' OG1' ' A' ' 236' ' ' THR . 85.8 mt-10 -61.87 -34.28 75.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.578 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.1 OUTLIER -64.77 -42.08 95.39 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.837 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -64.3 -49.09 73.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.512 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.42 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.126 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.3 -43.25 95.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.456 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -56.43 -51.28 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 110.381 -178.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -66.54 -39.95 88.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.744 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -58.89 -53.99 52.13 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.207 0.527 . . . . 0.0 110.447 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 247' ' ' LEU . 4.5 mm? -64.08 -33.81 76.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.444 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.716 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 88.9 tttt -57.28 -44.96 84.48 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.224 0.535 . . . . 0.0 110.072 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -68.96 -44.04 73.77 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.604 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -61.24 -47.2 87.15 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 120.991 0.424 . . . . 0.0 111.088 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.716 ' HG3' ' O ' ' A' ' 248' ' ' LYS . 1.0 OUTLIER -61.28 -36.27 79.58 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.72 87.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.69 -48.16 80.5 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.233 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.524 HD11 ' CE2' ' A' ' 218' ' ' PHE . 1.2 tt -65.02 -34.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.096 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -64.57 -44.73 89.8 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.34 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.82 -44.31 96.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.332 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -44.8 73.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -60.71 -40.76 93.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.29 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -59.78 -47.22 86.57 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.515 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -63.94 -34.52 78.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.397 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.591 HE21 ' CG2' ' A' ' 297' ' ' THR . 72.5 mm-40 -61.8 -46.87 87.66 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.189 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.99 -46.76 87.83 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.05 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -64.38 -34.96 79.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.987 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 60.5 tp -62.62 -42.9 99.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.107 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -64.81 -44.66 89.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.712 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.42 -43.26 98.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.192 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.4 -38.6 87.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.099 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -61.54 -46.79 88.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.565 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.87 -49.12 78.93 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -61.89 -38.75 89.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.516 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.04 -43.06 99.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.261 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -60.27 -43.27 96.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.403 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -65.9 -39.88 91.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -65.29 -38.32 89.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.941 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -63.9 -30.37 71.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.517 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 6.4 t -59.39 -40.16 85.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.536 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 91.5 t -60.75 -45.31 97.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.495 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 86.35 18.72 58.45 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -64.03 -38.24 90.36 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.292 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 81.47 -164.76 45.73 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 63.27 -70.58 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.8 0.333 . . . . 0.0 110.619 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 280' ' ' GLY . 11.2 ptp85 -67.97 -24.56 65.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.825 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.9 -47.59 92.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.421 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 38.6 t -66.55 -44.86 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.18 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.03 -49.49 77.19 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.876 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 71.7 m -60.83 -43.96 97.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -63.63 -39.06 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.724 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -58.36 -57.18 14.02 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.95 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.686 ' HD3' HD23 ' A' ' 292' ' ' LEU . 17.1 mmtm -64.28 -36.49 84.27 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.077 179.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -49.23 -50.05 40.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.78 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.4 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.601 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.686 HD23 ' HD3' ' A' ' 289' ' ' LYS . 22.8 tp -59.98 -49.72 76.58 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.548 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.17 -42.07 99.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.014 0.435 . . . . 0.0 109.891 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.59 ' O ' ' OG1' ' A' ' 297' ' ' THR . 12.3 tm-20 -60.97 -40.12 92.2 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.04 -43.22 99.46 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.26 -43.95 98.04 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.227 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.591 ' CG2' HE21 ' A' ' 261' ' ' GLN . 25.3 p -57.36 -43.86 83.87 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.99 0.424 . . . . 0.0 110.121 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -62.79 -46.36 88.36 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.137 0.494 . . . . 0.0 110.681 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.52 -39.92 89.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.144 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.85 -43.86 98.0 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.152 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.72 -42.55 96.42 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -61.52 -44.89 96.25 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.137 0.494 . . . . 0.0 110.616 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 18.3 m -60.52 -43.93 96.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.352 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.8 t -59.81 -42.76 90.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.921 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.71 -50.51 72.97 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.031 0.443 . . . . 0.0 110.596 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -63.77 -41.18 98.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.682 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -66.23 -34.98 79.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.011 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.664 HD22 HG21 ' A' ' 223' ' ' VAL . 19.3 mt -62.14 -43.72 98.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.378 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -68.53 -43.87 75.83 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.737 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -64.15 -49.53 71.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.112 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 311' ' ' LEU . 28.1 mt -63.89 -41.32 97.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.9 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 74.7 m -59.64 -41.81 91.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.545 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -68.4 -47.47 57.49 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.445 ' HB3' HD13 ' A' ' 323' ' ' LEU . 89.0 mtm180 -66.1 -42.35 89.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.785 0.326 . . . . 0.0 111.269 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.4 mm -70.23 -23.75 25.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.94 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.4 t -59.66 -43.84 93.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 109.735 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -100.82 4.31 42.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.732 179.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.547 ' O ' HD21 ' A' ' 323' ' ' LEU . . . 54.57 -101.83 0.13 Allowed 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.288 -178.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.454 ' HB3' HD21 ' A' ' 323' ' ' LEU . 0.0 OUTLIER -177.37 146.82 0.49 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.989 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -94.24 -26.16 16.76 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 37.5 p-10 -160.8 65.34 0.3 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.464 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 60.06 147.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.315 -179.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.547 HD21 ' O ' ' A' ' 318' ' ' ALA . 28.0 mt . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.552 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.492 ' CD1' ' O ' ' A' ' 2' ' ' SER . 55.4 t80 . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.492 ' O ' ' CD1' ' A' ' 1' ' ' TYR . 48.2 t -66.06 149.2 50.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.641 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -128.95 141.43 51.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.73 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -131.21 127.25 37.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.414 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -132.8 149.76 52.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.24 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -77.35 142.25 39.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.983 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.23 149.76 35.91 Favored Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.459 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.58 149.2 90.28 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.508 2.139 . . . . 0.0 112.174 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt -145.18 87.72 7.04 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.593 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.432 ' O ' ' CB ' ' A' ' 11' ' ' SER . 52.1 Cg_exo -52.07 -39.33 70.5 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.61 2.206 . . . . 0.0 112.053 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 10' ' ' PRO . 1.4 t 77.78 80.23 0.12 Allowed Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.23 146.77 93.52 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 123.126 2.55 . . . . 0.0 112.358 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -64.55 134.66 54.85 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.526 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.8 mtp180 -99.75 134.99 41.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.51 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -78.14 -82.23 0.09 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.63 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m 59.75 117.85 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.842 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.449 ' O ' ' O ' ' A' ' 18' ' ' GLU . . . -63.47 -40.41 98.77 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.834 -0.907 . . . . 0.0 110.834 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.449 ' O ' ' O ' ' A' ' 17' ' ' GLY . 79.9 mm-40 54.97 114.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.883 0.373 . . . . 0.0 110.82 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -65.58 -40.68 92.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.745 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -104.67 -175.08 2.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.489 ' C ' ' SD ' ' A' ' 22' ' ' MET . 85.5 mtp180 -92.38 -4.08 54.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.78 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.538 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -133.56 137.98 45.8 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.027 0.441 . . . . 0.0 111.109 -179.359 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 16.6 pt-20 -65.12 -42.59 93.77 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' H ' ' HG2' ' A' ' 24' ' ' LYS . 13.2 pttm -57.0 -45.42 83.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.0 0.429 . . . . 0.0 109.963 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.1 mp -61.62 -41.51 97.58 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.1 m-80 -62.09 -38.75 90.03 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.199 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -59.01 -48.78 80.36 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.885 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.436 ' N ' HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -61.97 -42.14 98.79 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.116 179.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.645 ' NE1' ' NE2' ' A' ' 33' ' ' GLN . 61.1 t-105 -61.12 -45.06 96.23 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.072 0.463 . . . . 0.0 110.383 179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.439 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 81.3 tt0 -56.85 -46.04 82.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.372 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -61.71 -40.56 95.48 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.474 -0.491 . . . . 0.0 110.281 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.91 -43.9 86.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.645 ' NE2' ' NE1' ' A' ' 29' ' ' TRP . 88.2 mt-30 -62.81 -38.5 90.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.232 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.439 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -61.19 -41.66 97.21 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.376 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.17 -41.17 97.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.337 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.401 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.2 OUTLIER 65.33 104.83 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.764 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.522 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -125.47 158.51 64.2 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.354 179.614 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -39.12 153.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.478 0 C-N-CA 122.593 2.195 . . . . 0.0 112.417 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.5 -41.77 68.25 Favored 'Trans proline' 0 N--CA 1.499 1.837 0 C-N-CA 122.812 2.341 . . . . 0.0 112.538 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 70.6 t -62.69 -46.42 96.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -64.76 -38.52 91.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.335 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.25 -46.08 88.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.18 -42.67 83.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.866 0.365 . . . . 0.0 110.816 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -67.63 -45.27 75.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.564 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.52 HD13 ' OH ' ' A' ' 88' ' ' TYR . 59.3 tp -63.13 -48.89 76.57 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.523 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -60.3 -41.31 93.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.282 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.583 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.97 -50.41 74.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.115 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -57.65 -48.11 80.4 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.946 0.403 . . . . 0.0 110.996 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.71 -39.82 81.91 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -60.01 -40.46 89.34 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.882 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.583 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.6 mm -62.45 -43.84 98.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -58.42 -42.89 88.28 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.684 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.49 -49.56 77.05 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.155 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -63.0 -41.57 99.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.792 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 55' ' ' ASP . 48.5 t0 -63.34 -39.38 94.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.356 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -61.33 -46.38 90.51 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.848 0.356 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.6 tp -61.4 -43.52 98.73 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.722 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.411 ' O ' HD13 ' A' ' 62' ' ' LEU . . . -61.98 -44.5 96.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.696 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.3 t90 -56.33 -42.45 77.7 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.2 tttt -60.52 -45.92 92.03 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.688 -0.405 . . . . 0.0 109.977 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -60.47 -42.64 96.65 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.265 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 58' ' ' ALA . 10.3 mp -62.03 -40.64 96.4 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.341 -0.544 . . . . 0.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.96 -40.72 85.6 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.642 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.5 tt -60.67 -44.63 96.24 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -63.84 -37.33 86.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.307 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 95.98 52.92 1.57 Allowed Glycine 0 CA--C 1.526 0.746 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 77.7 mt -112.21 -51.17 2.86 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.848 0.356 . . . . 0.0 110.986 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -66.27 138.08 57.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.333 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -159.36 -30.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.503 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 71' ' ' GLY . 47.5 p-10 -64.92 -34.26 77.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.594 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.539 ' N ' ' OD1' ' A' ' 70' ' ' ASP . . . 89.13 2.35 77.71 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -66.81 -34.39 77.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.453 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.491 ' HD2' ' H ' ' A' ' 73' ' ' LYS . 2.7 mptp? -61.44 -68.09 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.074 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -51.74 -39.14 57.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.367 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.53 95.11 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 120.747 0.308 . . . . 0.0 110.412 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.487 ' NH1' HD21 ' A' ' 80' ' ' ASN . 73.7 ttt-85 -62.62 -43.07 99.73 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.01 -43.37 98.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.573 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.58 -44.69 98.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.148 0.499 . . . . 0.0 109.95 179.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.553 ' O ' HG23 ' A' ' 83' ' ' VAL . 7.9 mmp_? -59.86 -41.74 92.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.236 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.487 HD21 ' NH1' ' A' ' 76' ' ' ARG . 92.1 m-20 -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.532 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.579 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.22 -49.19 78.79 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.753 -179.55 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.422 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 50.8 t-20 -64.21 -40.44 96.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.678 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 79' ' ' ARG . 55.6 t -62.0 -45.81 97.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.773 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.65 -48.85 86.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.318 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.5 -38.56 90.08 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.76 77.27 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.319 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.73 -46.1 83.67 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.288 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.52 ' OH ' HD13 ' A' ' 45' ' ' LEU . 12.8 m-85 -63.85 -27.7 69.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.946 0.403 . . . . 0.0 110.121 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.38 29.37 73.08 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 98.3 mt -102.3 17.33 23.73 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.878 0.37 . . . . 0.0 110.798 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -57.13 -48.59 78.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.777 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.467 ' O ' ' O ' ' A' ' 93' ' ' LYS . . . 107.02 55.52 0.64 Allowed Glycine 0 CA--C 1.528 0.889 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.467 ' O ' ' O ' ' A' ' 92' ' ' GLY . 98.7 mttt 45.3 -175.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.857 0.36 . . . . 0.0 110.69 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 94' ' ' LYS . 25.0 pttm -109.08 63.46 0.6 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.956 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.457 ' OD2' ' O ' ' A' ' 97' ' ' ARG . 20.8 t70 -88.88 101.47 14.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.891 0.377 . . . . 0.0 110.658 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.93 -24.3 55.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.846 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.457 ' O ' ' OD2' ' A' ' 95' ' ' ASP . 19.2 ptp180 -80.35 140.73 35.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.678 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -145.71 160.57 41.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.263 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.6 t -115.74 130.55 70.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.1 p -62.93 -50.46 70.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.242 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.8 t -75.66 145.11 41.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.81 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -88.72 80.81 7.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.909 0.385 . . . . 0.0 110.286 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 8.3 t -65.84 -21.12 66.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.688 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.425 HD13 ' C ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER 50.37 89.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.664 179.818 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.2 t -143.62 134.4 25.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.551 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -99.29 -20.38 18.05 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.8 t -147.19 153.23 39.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.893 0.377 . . . . 0.0 110.706 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -162.12 153.99 18.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.347 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.54 ' N ' ' OE1' ' A' ' 109' ' ' GLU . 55.8 mp0 -127.44 141.21 51.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.78 0.324 . . . . 0.0 110.383 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.584 ' CG ' ' H ' ' A' ' 111' ' ' GLY . 10.1 p-10 -60.37 -82.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.651 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.584 ' H ' ' CG ' ' A' ' 110' ' ' ASP . . . 156.4 -98.26 0.17 Allowed Glycine 0 CA--C 1.522 0.501 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.2 tp -148.39 159.51 43.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.791 0.329 . . . . 0.0 110.743 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 46.0 p30 -115.35 12.51 16.38 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.018 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 5.3 m-20 -107.04 117.89 55.35 Favored Pre-proline 0 N--CA 1.466 0.369 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.698 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -66.9 -30.21 40.32 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.077 1.852 . . . . 0.0 112.537 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -68.17 -45.29 73.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.722 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 58.2 mt -82.7 -28.09 30.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.882 0.372 . . . . 0.0 110.644 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 77.9 mt-10 -60.48 -25.2 65.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.937 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.49 -55.76 29.53 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.52 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 120' ' ' LEU . 32.1 mt -68.96 -42.33 76.76 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 112.112 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.64 ' CE3' HD22 ' A' ' 135' ' ' LEU . 7.5 t-105 -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.739 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.593 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.4 m-70 -68.0 -32.92 73.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.054 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.464 ' O ' ' CB ' ' A' ' 127' ' ' SER . 13.1 tptt -57.52 -49.56 75.93 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.96 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -69.15 -47.41 65.09 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.654 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.455 ' HE3' ' HE1' ' A' ' 121' ' ' TRP . 37.3 ttmt -54.6 -50.72 67.38 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.649 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 54.7 m -74.31 -41.9 60.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.932 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 9.3 t -48.62 -26.15 2.11 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 -178.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.67 -94.22 0.1 OUTLIER Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.041 -1.076 . . . . 0.0 111.515 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 131' ' ' SER . 13.4 pttm -162.83 30.97 0.1 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.515 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 6.5 m-85 -64.31 49.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.233 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.576 ' N ' ' O ' ' A' ' 129' ' ' LYS . 4.6 p -104.5 137.4 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.197 0.522 . . . . 0.0 111.767 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 95.45 -97.34 2.1 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-N 115.234 -0.893 . . . . 0.0 112.218 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 137' ' ' LYS . 97.9 mt-10 -78.14 -43.91 27.49 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.8 0.333 . . . . 0.0 111.679 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 138' ' ' LEU . 48.2 mt-10 -60.61 -52.52 64.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.054 0.454 . . . . 0.0 110.197 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.64 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -62.05 -41.44 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.938 179.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -61.3 -37.97 85.15 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 133' ' ' GLU . 56.1 mmtt -62.03 -42.41 99.15 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 134' ' ' GLU . 9.1 mp -59.73 -42.56 93.42 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.85 -36.94 85.96 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.569 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 72.5 mtp85 -54.1 -42.13 69.06 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 118.588 -1.245 . . . . 0.0 108.149 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -69.23 -41.62 76.76 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.678 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -57.23 -57.57 12.02 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.583 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.56 -39.14 83.05 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.179 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.569 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 44.9 m170 -54.61 -43.16 71.96 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.416 -0.514 . . . . 0.0 109.846 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.62 -39.13 88.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.574 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -59.75 -46.3 89.57 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.192 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 10.2 pt-20 -69.89 -44.82 68.97 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.419 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 86.1 mttt -62.92 -46.7 86.58 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.233 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.444 HG22 HD13 ' A' ' 197' ' ' ILE . 55.1 t -64.49 -44.27 96.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.397 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.733 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.4 m170 -60.87 -38.54 85.98 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.465 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -61.49 -44.75 96.53 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.992 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.557 ' CD1' ' HE3' ' A' ' 193' ' ' LYS . 31.3 m-85 -66.74 -49.67 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.381 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -65.66 -41.03 93.01 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.953 0.406 . . . . 0.0 111.164 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 150' ' ' HIS . 66.9 t -63.57 -44.54 98.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.727 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.2 mt -63.41 -44.89 93.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.511 179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 20.6 mt -63.9 -42.59 97.39 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.692 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.477 ' O ' ' OG ' ' A' ' 160' ' ' SER . 76.3 mm-40 -67.32 -29.89 69.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.098 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 62.6 m -67.79 -48.24 66.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.568 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 2.7 pp -78.82 -21.84 47.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.823 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.477 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 79.0 p -60.44 -35.94 77.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.715 -179.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -64.18 -42.5 96.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.12 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.656 ' C ' ' H ' ' A' ' 164' ' ' GLU . 12.6 p -81.54 178.47 8.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.384 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 65.19 -30.06 0.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.998 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.656 ' H ' ' C ' ' A' ' 162' ' ' THR . 96.1 mt-10 -105.54 55.53 0.69 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.023 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.531 HG23 ' O ' ' A' ' 165' ' ' ILE . 11.2 tp -134.76 126.61 47.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.546 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 45.6 m170 44.63 24.71 0.11 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.115 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.406 ' N ' ' C ' ' A' ' 165' ' ' ILE . 47.5 tp10 -95.45 116.29 28.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.495 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.404 ' OD1' ' O ' ' A' ' 167' ' ' GLU . 92.0 m-20 -147.88 64.33 1.11 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.541 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.97 133.22 64.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.49 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.2 tt -131.48 136.11 58.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.572 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -135.36 160.05 69.43 Favored Pre-proline 0 C--O 1.232 0.166 0 CA-C-O 120.806 0.336 . . . . 0.0 110.203 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -69.26 84.94 0.56 Allowed 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.654 2.236 . . . . 0.0 112.182 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 8.1 m -153.15 145.88 24.32 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.436 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -59.96 -49.14 78.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.907 0.384 . . . . 0.0 110.085 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.606 ' O ' ' N ' ' A' ' 177' ' ' ASP . 20.0 mt -122.99 111.01 16.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.955 179.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 27.6 t 44.59 -85.15 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.586 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.606 ' N ' ' O ' ' A' ' 175' ' ' LEU . 28.1 t70 -158.95 49.75 0.35 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.725 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.456 HD11 ' CB ' ' A' ' 175' ' ' LEU . 1.8 pt -127.1 160.26 36.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.572 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -87.82 -6.75 57.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.487 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 106.34 48.0 1.02 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 50.2 m -123.69 2.35 8.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.569 0.223 . . . . 0.0 110.943 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 1.018 HG12 ' H ' ' A' ' 183' ' ' LEU . 4.2 t -143.83 -167.52 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.736 0.303 . . . . 0.0 110.514 -179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 1.018 ' H ' HG12 ' A' ' 182' ' ' VAL . 2.0 mt 62.26 -30.41 0.08 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.915 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.636 ' H ' ' C ' ' A' ' 182' ' ' VAL . 29.7 p80 -58.24 -45.32 87.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.644 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.594 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 78.2 p -62.6 -41.77 99.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.398 -179.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -61.97 -45.25 94.47 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.099 0.476 . . . . 0.0 110.867 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . 0.759 ' NE2' HD22 ' A' ' 183' ' ' LEU . 27.6 m-70 -66.41 -37.6 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.059 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 57.8 m -60.87 -44.02 97.63 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.209 -0.451 . . . . 0.0 109.913 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -62.64 -38.35 89.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.018 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 3.4 mt -62.17 -39.79 93.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.156 179.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -66.64 -42.47 86.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.007 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -68.69 -35.79 77.66 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.567 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.557 ' HE3' ' CD1' ' A' ' 152' ' ' TYR . 26.9 mtpt -63.34 -46.95 84.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.113 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.696 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -72.24 -35.77 68.91 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.286 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.451 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 11.0 mmt85 -64.29 -41.36 96.91 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.626 179.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 69.8 m -65.47 -45.22 84.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.229 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.444 HD13 HG22 ' A' ' 149' ' ' VAL . 90.7 mt -66.33 -44.31 91.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.176 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -65.73 -40.83 92.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.029 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 195' ' ' ARG . 79.3 mt-30 -64.32 -36.68 84.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.23 178.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.98 -51.83 50.04 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 31.0 mt -64.29 -41.63 96.78 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.222 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -63.58 -36.6 84.34 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.71 ' HE ' HG21 ' A' ' 207' ' ' VAL . 0.0 OUTLIER -63.16 -44.16 96.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.72 179.101 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 33.3 mt -62.02 -39.03 90.91 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -61.93 -45.6 92.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.968 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.69 ' O ' ' N ' ' A' ' 210' ' ' GLN . 90.3 mmt-85 -65.76 -42.35 90.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.092 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.71 HG21 ' HE ' ' A' ' 203' ' ' ARG . 77.0 t -64.09 -45.36 96.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.061 0.457 . . . . 0.0 110.319 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.3 p -67.47 -28.85 68.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.659 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -101.21 -14.11 17.84 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.712 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.69 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.1 tt0 -140.15 -20.32 0.87 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.619 0.247 . . . . 0.0 111.361 -179.031 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.682 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -78.31 23.35 2.82 Favored Glycine 0 N--CA 1.461 0.339 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.598 ' CG ' ' N ' ' A' ' 213' ' ' SER . 71.7 t80 -52.26 175.45 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.611 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.598 ' N ' ' CG ' ' A' ' 212' ' ' TYR . 29.4 t -56.27 132.77 51.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.018 -179.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.617 HG22 ' N ' ' A' ' 215' ' ' GLU . 90.4 m -148.2 164.81 32.83 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.772 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.617 ' N ' HG22 ' A' ' 214' ' ' THR . 5.4 pt-20 -128.35 101.92 6.43 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.143 -0.481 . . . . 0.0 109.875 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . 0.509 ' C ' ' H ' ' A' ' 218' ' ' PHE . . . 178.15 -79.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.629 -179.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 64.13 -15.37 0.08 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.006 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.509 ' H ' ' C ' ' A' ' 216' ' ' ALA . 51.6 m-85 -147.57 -50.23 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.35 -0.54 . . . . 0.0 112.291 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 220' ' ' GLU . 82.0 tt0 -62.99 -105.96 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.815 -179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 219' ' ' GLU . 2.8 mt-10 55.36 153.59 0.06 OUTLIER Pre-proline 0 N--CA 1.472 0.64 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.675 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -83.12 81.79 2.28 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 122.201 1.934 . . . . 0.0 112.07 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -147.28 -98.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.968 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.552 HG13 ' N ' ' A' ' 224' ' ' ILE . 7.5 p -60.52 -46.04 96.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.659 0 CA-C-O 121.154 0.502 . . . . 0.0 110.801 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.754 HD11 ' CE1' ' A' ' 250' ' ' PHE . 0.7 OUTLIER -63.41 -35.64 73.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.818 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -62.09 -41.87 98.63 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.067 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 9.6 mt -59.39 -40.58 87.01 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.614 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 46.6 m0 -60.48 -43.98 96.39 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.04 178.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.624 HD23 ' OG ' ' A' ' 232' ' ' SER . 3.6 mt -68.9 -43.82 74.45 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.331 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -39.64 -37.68 0.53 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.396 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -70.17 -45.87 65.84 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.173 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.624 ' OG ' HD23 ' A' ' 229' ' ' LEU . 91.6 p -80.11 -6.88 58.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.394 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -67.26 -121.28 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.376 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . 0.521 ' C ' HD22 ' A' ' 235' ' ' LEU . 0.2 OUTLIER -163.38 69.58 0.22 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 110.544 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 235' ' ' LEU . 3.4 mm? -100.76 -171.91 2.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.711 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 10.9 p -82.97 163.15 21.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.699 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -63.79 -46.89 83.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.892 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.51 -43.13 95.06 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.556 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.525 ' OE1' ' N ' ' A' ' 323' ' ' LEU . 47.2 tp10 -63.74 -36.29 83.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.638 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.2 OUTLIER -61.79 -45.31 94.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.384 -179.615 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -64.24 -47.49 79.46 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.89 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.56 -41.98 99.25 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.816 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.498 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.23 -43.95 93.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.437 178.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -47.5 85.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.211 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.91 -46.97 79.45 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.354 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -56.44 -53.13 61.0 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.292 0.568 . . . . 0.0 110.382 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.03 -40.3 97.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.573 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 64.1 tttp -50.47 -45.46 56.21 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.76 -41.83 91.6 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.221 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . 0.754 ' CE1' HD11 ' A' ' 224' ' ' ILE . 0.0 OUTLIER -58.64 -51.45 69.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.447 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.551 ' N ' ' CG ' ' A' ' 250' ' ' PHE . 11.6 pt-20 -59.59 -37.5 78.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.04 95.77 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.525 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.3 -46.22 87.73 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.41 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 0.4 OUTLIER -64.64 -38.7 83.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -60.34 -44.91 95.09 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.515 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -61.63 -43.91 97.98 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . 0.532 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.0 OUTLIER -55.95 -43.97 77.99 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.539 -0.464 . . . . 0.0 109.78 179.226 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . 0.532 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 39.9 t-20 -59.92 -41.16 91.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.237 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -59.0 -47.95 83.37 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.905 0.384 . . . . 0.0 110.296 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -61.8 -37.59 84.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.303 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.429 HE21 ' HB ' ' A' ' 297' ' ' THR . 62.1 mm-40 -59.16 -43.84 92.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.307 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -61.61 -47.76 83.98 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.13 0.49 . . . . 0.0 110.041 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -64.27 -35.06 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.03 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 65.3 tp -62.04 -42.99 99.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.201 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.21 -46.2 88.11 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.456 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.13 -43.63 98.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.164 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.94 -35.55 78.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.251 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . 0.53 ' NE2' ' NE ' ' A' ' 272' ' ' ARG . 24.7 t60 -64.05 -46.1 85.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.318 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.95 -46.15 91.86 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.045 0.45 . . . . 0.0 110.389 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.47 -39.41 90.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.356 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.697 ' O ' HD23 ' A' ' 271' ' ' LEU . 2.6 tt -60.42 -44.59 95.61 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . 0.53 ' NE ' ' NE2' ' A' ' 268' ' ' HIS . 99.8 mtt180 -60.33 -44.17 95.75 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.21 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -67.77 -39.62 84.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.656 -0.417 . . . . 0.0 110.83 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.557 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -60.59 -36.81 79.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.007 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.61 -24.5 63.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 0.0 110.364 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 9.0 t -88.32 3.46 49.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.868 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.592 HG13 ' N ' ' A' ' 278' ' ' GLY . 11.3 p -61.11 -44.94 99.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.592 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 149.41 -98.44 0.19 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.72 -37.95 89.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.833 0.349 . . . . 0.0 110.164 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . 78.14 46.75 8.93 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -68.72 -32.77 72.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.741 0.305 . . . . 0.0 110.755 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . 0.441 HH11 ' CB ' ' A' ' 274' ' ' ALA . 9.4 ptm180 -91.07 0.96 57.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.995 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 39.2 t -61.49 -46.33 96.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.7 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.5 t -61.74 -44.78 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.139 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 53.1 ttt85 -62.68 -46.8 86.48 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.952 0.406 . . . . 0.0 110.924 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 6.1 t -63.22 -45.07 93.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -63.9 -39.79 94.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -58.76 -59.58 5.2 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.019 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.602 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.7 mmtp -64.02 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.866 -0.734 . . . . 0.0 110.044 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -46.19 -54.65 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.897 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.34 82.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.714 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.602 HD23 ' HD3' ' A' ' 289' ' ' LYS . 18.5 tp -59.77 -49.92 75.85 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.809 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.65 -42.0 98.16 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.38 0.61 . . . . 0.0 109.827 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.484 ' O ' ' OG1' ' A' ' 297' ' ' THR . 75.9 tt0 -62.91 -36.62 83.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.802 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -63.96 -42.86 98.13 Favored Glycine 0 CA--C 1.522 0.492 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.2 tpp85 -60.33 -44.47 95.47 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.08 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 35.2 p -58.87 -46.76 87.01 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.436 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -62.5 -45.07 94.7 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.05 0.453 . . . . 0.0 110.338 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -59.5 -39.99 85.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.71 -43.01 99.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.17 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -59.22 -42.15 97.09 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 61.5 t80 -61.93 -45.53 93.28 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.389 0.614 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 9.8 m -59.75 -42.58 93.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.763 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.74 -42.91 90.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -54.9 -52.17 63.75 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.571 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 50.1 mttt -62.46 -40.5 96.82 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.93 -0.708 . . . . 0.0 110.996 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -64.46 -36.32 83.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.188 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.614 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 12.4 mt -62.51 -43.74 98.08 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.448 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -66.94 -44.72 79.91 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.672 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -64.41 -48.55 74.97 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.405 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.459 HD12 ' CH2' ' A' ' 227' ' ' TRP . 31.8 mt -63.29 -41.73 99.01 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.523 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 11.5 t -61.0 -43.33 99.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.446 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -63.21 -51.8 52.23 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 120.931 -0.652 . . . . 0.0 111.682 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -67.2 -41.85 85.12 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.218 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 5.0 mm -63.76 -41.73 93.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 78.1 p -58.88 -41.22 86.61 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.502 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.439 ' O ' ' HB3' ' A' ' 318' ' ' ALA . 10.4 tpp180 -76.27 -70.13 0.46 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 117.814 -1.555 . . . . 0.0 108.146 176.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.608 ' HA ' HD11 ' A' ' 323' ' ' LEU . . . 69.01 89.6 0.1 Allowed 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 113.727 -1.578 . . . . 0.0 107.372 -178.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 77.2 mtp85 -69.47 150.23 47.42 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -176.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -69.28 -28.67 66.49 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.915 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -89.86 15.7 9.4 Favored 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 81.78 128.74 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.608 HD11 ' HA ' ' A' ' 318' ' ' ALA . 94.0 mt . . . . . 0 C--O 1.221 -0.427 0 CA-C-N 113.571 -1.649 . . . . 0.0 111.215 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m 56.37 84.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.014 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 68.5 ttp85 -81.11 140.45 35.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.115 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -49.74 154.48 1.01 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.458 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -127.04 140.54 52.22 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.648 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.445 ' O ' ' CB ' ' A' ' 7' ' ' GLN . 28.7 t-20 -173.78 165.11 4.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.314 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.445 ' CB ' ' O ' ' A' ' 6' ' ' ASN . 3.5 tp60 76.91 90.21 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.833 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -82.0 156.56 17.74 Favored 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 123.018 2.479 . . . . 0.0 112.34 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.794 ' H ' ' CD ' ' A' ' 10' ' ' PRO . 19.9 ttpt -122.52 -38.31 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.413 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.575 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.794 ' CD ' ' H ' ' A' ' 9' ' ' LYS . 26.0 Cg_exo -62.43 147.9 94.15 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.576 2.184 . . . . 0.0 112.238 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.3 p 173.21 67.58 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.613 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.589 ' O ' ' N ' ' A' ' 14' ' ' ARG . 73.4 Cg_endo -74.98 146.59 32.93 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.787 2.325 . . . . 0.0 111.697 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.544 ' C ' ' O ' ' A' ' 12' ' ' PRO . 68.1 tttt 23.29 -86.62 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.333 0.396 . . . . 0.0 110.769 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.589 ' N ' ' O ' ' A' ' 12' ' ' PRO . 84.8 mtt85 -114.54 167.32 10.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.303 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -79.25 -127.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.785 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -160.25 167.41 27.63 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.433 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -153.6 165.19 31.4 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -130.99 143.36 50.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.833 0.349 . . . . 0.0 110.87 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -69.61 -35.3 75.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.575 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 -130.62 157.82 41.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.781 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.679 ' NH2' ' OE2' ' A' ' 53' ' ' GLU . 89.3 mtm-85 -95.85 12.37 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.018 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.448 ' SD ' ' C ' ' A' ' 21' ' ' ARG . 1.2 mpt? -138.03 141.39 40.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.035 0.445 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 24' ' ' LYS . 20.2 pt-20 -65.48 -43.72 89.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.424 ' N ' ' HG3' ' A' ' 23' ' ' GLU . 14.0 pttm -55.66 -44.62 77.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.2 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 22' ' ' MET . 95.7 mt -62.85 -42.38 99.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.025 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -62.93 -41.69 99.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.377 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -60.02 -45.42 92.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.572 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 28' ' ' LEU . 92.4 mt -61.89 -42.57 99.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.254 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 27.7 t-105 -62.58 -45.96 90.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.384 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -57.54 -43.49 84.45 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.252 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.24 -43.05 99.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.591 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.09 80.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.942 0.401 . . . . 0.0 110.342 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.635 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 76.3 mt-30 -61.65 -38.66 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.349 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.536 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 60.1 ttm-85 -60.57 -42.16 96.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.384 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.0 mt -69.55 -30.15 67.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.732 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.635 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 24.7 m80 65.99 118.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.743 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -138.07 154.46 74.21 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.859 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.31 154.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 122.718 2.279 . . . . 0.0 112.364 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.67 -48.7 0.38 Allowed 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 122.617 2.211 . . . . 0.0 112.403 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.543 ' O ' ' OE1' ' A' ' 44' ' ' GLU . 71.7 t -61.67 -48.65 87.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.435 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.7 ttp85 -65.04 -41.67 94.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.402 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.47 -42.4 99.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.619 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.82 88.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.414 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.543 ' OE1' ' O ' ' A' ' 40' ' ' VAL . 3.7 mp0 -67.91 -41.22 83.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.652 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.7 tp -61.84 -48.33 81.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.154 0.502 . . . . 0.0 110.622 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -61.2 -41.44 96.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.604 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -57.92 -48.61 79.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.603 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -55.75 -48.97 74.34 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.94 0.4 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.9 mt -58.25 -39.78 80.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.153 0.501 . . . . 0.0 109.833 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.81 -38.42 85.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.604 HG12 ' O ' ' A' ' 47' ' ' ALA . 37.2 mm -62.3 -42.57 95.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.671 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -57.38 -50.85 71.67 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.471 179.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.679 ' OE2' ' NH2' ' A' ' 21' ' ' ARG . 82.2 tt0 -55.24 -49.25 72.49 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.444 0.64 . . . . 0.0 110.296 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -60.73 -42.74 97.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.314 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -62.02 -38.24 87.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.4 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.45 -49.23 76.93 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.89 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 14.8 mt -61.32 -42.25 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.456 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -41.78 97.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.49 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -60.67 -41.42 95.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.291 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -58.88 -46.01 88.84 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -59.53 -43.29 93.5 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.85 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.05 -37.51 87.47 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.009 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -57.55 -45.6 84.92 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt -61.9 -41.25 97.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.867 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -70.28 -22.09 62.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.314 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.02 38.16 64.01 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 93.4 mt -99.18 -9.44 23.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.758 0.313 . . . . 0.0 110.789 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.46 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 26.7 p-10 -67.36 138.78 57.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.422 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -60.44 -81.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.613 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.411 ' OD1' ' O ' ' A' ' 70' ' ' ASP . 52.2 t0 -154.67 45.92 0.54 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.51 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 83.01 10.8 82.37 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -70.28 -35.27 73.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.856 0.36 . . . . 0.0 110.332 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -64.75 -52.28 57.81 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.129 0.49 . . . . 0.0 110.583 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 22.4 pt-20 -62.65 -38.94 92.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.979 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.47 -42.31 91.73 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.323 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.8 ttt-85 -63.64 -43.52 96.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -63.73 -42.98 97.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.366 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.82 -44.47 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.192 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.604 ' O ' HG23 ' A' ' 83' ' ' VAL . 3.3 mmp_? -59.83 -42.03 92.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.256 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 84' ' ' ILE . 92.6 m-20 -63.57 -39.85 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.294 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.637 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.83 -48.15 82.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.277 0.561 . . . . 0.0 110.171 -179.491 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.77 -38.16 88.3 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.412 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 79' ' ' ARG . 53.6 t -63.71 -46.24 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.424 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.9 mt -59.67 -51.32 74.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.473 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.31 -42.47 92.99 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.062 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.51 99.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.809 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -62.83 -49.22 75.76 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.564 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -67.6 -27.76 67.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.032 179.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 72.97 25.51 73.53 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 90' ' ' LEU . 50.0 mt -91.86 -1.67 57.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.248 . . . . 0.0 110.75 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -61.53 -46.31 90.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.444 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 149.51 170.09 16.65 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.525 ' CG ' ' N ' ' A' ' 94' ' ' LYS . 20.1 ptmt -100.49 -49.11 4.32 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.726 0.298 . . . . 0.0 110.427 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.525 ' N ' ' CG ' ' A' ' 93' ' ' LYS . 10.7 ttmm -148.57 124.26 10.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.617 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.517 ' N ' ' OD1' ' A' ' 95' ' ' ASP . 14.8 p-10 -178.72 103.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.79 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 97' ' ' ARG . . . -65.88 -41.08 92.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.895 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.473 ' O ' ' O ' ' A' ' 96' ' ' ALA . 55.1 ttp180 44.8 100.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.609 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 58.14 -171.49 0.1 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.432 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.598 HG22 ' N ' ' A' ' 100' ' ' THR . 4.1 p -134.23 163.51 36.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.517 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.598 ' N ' HG22 ' A' ' 99' ' ' VAL . 53.9 p -45.73 168.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.609 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 25.9 t -48.27 105.48 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.817 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -64.72 -41.16 96.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.604 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.0 t 56.5 78.54 0.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.587 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.671 HD13 ' O ' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -62.06 -45.39 93.77 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 59.5 m -138.43 -38.01 0.54 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.493 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 144.63 -56.09 0.54 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 45.11 71.25 0.28 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.874 0.369 . . . . 0.0 110.593 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -124.88 123.09 39.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.613 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.443 ' OE1' ' N ' ' A' ' 109' ' ' GLU . 53.8 mp0 -79.11 120.79 24.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.036 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 109' ' ' GLU . 87.5 m-20 -135.24 148.92 49.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.56 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -147.83 -106.97 0.45 Allowed Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.3 mt -112.11 132.72 54.69 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -128.83 -57.13 1.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.398 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.52 136.53 71.34 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.636 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.06 -36.71 66.54 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 122.527 2.151 . . . . 0.0 112.302 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.443 HH11 ' HD2' ' A' ' 116' ' ' ARG . 52.1 mtm180 -60.35 -44.8 95.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.692 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.24 -40.26 95.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.013 0.435 . . . . 0.0 110.572 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.554 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 95.7 mt-10 -61.6 -39.41 91.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.573 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 55.6 mtmt -61.06 -42.4 98.42 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.409 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.49 -48.02 79.37 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.273 0.559 . . . . 0.0 111.88 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.558 ' CE3' HD22 ' A' ' 135' ' ' LEU . 19.1 t-105 -61.98 -48.42 80.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.426 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.554 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.6 m-70 -69.26 -29.92 67.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.335 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.626 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.5 tptt -58.58 -52.01 67.48 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.894 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.26 -46.46 49.82 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.433 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 46.4 tttt -52.0 -47.43 64.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.669 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.2 m -82.87 -43.98 15.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.863 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.567 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 20.6 m -44.53 -28.92 0.64 Allowed 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.155 -178.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -158.29 -96.84 0.12 Allowed Glycine 0 N--CA 1.46 0.284 0 C-N-CA 119.626 -1.273 . . . . 0.0 111.356 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.63 ' O ' ' N ' ' A' ' 131' ' ' SER . 98.7 mttt -155.98 21.3 0.38 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.796 ' HA ' ' HG3' ' A' ' 134' ' ' GLU . 2.9 m-85 -62.45 49.44 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.907 -178.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.63 ' N ' ' O ' ' A' ' 129' ' ' LYS . 1.0 OUTLIER -112.39 110.77 21.17 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.378 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 133.31 -98.8 0.35 Allowed Glycine 0 CA--C 1.53 0.988 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.816 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.2 mm-40 -81.85 -44.05 17.41 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.495 -0.415 . . . . 0.0 111.31 -179.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.948 ' H ' ' CD ' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -63.73 -46.11 86.85 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.558 HD22 ' CE3' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -62.44 -41.9 99.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.097 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -62.98 -37.1 85.79 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.468 ' O ' ' OE1' ' A' ' 141' ' ' GLU . 59.3 mttp -61.69 -43.11 99.49 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.324 0.583 . . . . 0.0 109.839 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 134' ' ' GLU . 2.7 mm? -59.47 -43.68 93.18 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.95 -37.38 87.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.619 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -51.38 -42.07 61.12 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.584 ' N ' ' OE1' ' A' ' 141' ' ' GLU . 6.0 mp0 -68.55 -45.47 72.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.374 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -56.6 -52.74 63.69 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.357 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.59 -39.94 89.94 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.238 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.8 m170 -55.5 -40.87 72.29 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.481 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.412 ' CE1' HG23 ' A' ' 197' ' ' ILE . 4.2 m-70 -64.97 -41.72 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.786 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -60.19 -48.89 79.81 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.763 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 18.5 pt-20 -70.93 -46.28 62.73 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.512 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 68.1 mttm -61.57 -43.2 99.3 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.542 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 43.4 t -64.65 -43.84 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.731 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.752 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -62.7 -36.18 82.13 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.452 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 147' ' ' GLU . 79.4 mm-40 -65.04 -48.04 75.25 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.55 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -67.96 -42.17 81.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.933 0.397 . . . . 0.0 110.432 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -69.45 -45.87 68.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.015 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.752 HG23 ' O ' ' A' ' 150' ' ' HIS . 71.6 t -62.71 -46.47 96.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.064 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 26.3 mt -63.7 -43.97 95.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.575 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.439 ' O ' ' OG ' ' A' ' 160' ' ' SER . 31.9 mt -63.98 -43.45 95.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.605 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.615 ' OE1' ' N ' ' A' ' 157' ' ' GLU . 0.3 OUTLIER -67.42 -29.47 68.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 109.882 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 59.0 m -66.38 -52.18 49.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.006 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' A' ' 159' ' ' LEU . 2.9 pp -79.85 -22.06 43.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.944 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 156' ' ' LEU . 31.2 m -72.35 -20.09 61.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.976 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.539 ' CG ' ' N ' ' A' ' 162' ' ' THR . 35.0 ptt180 -58.08 -46.77 84.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.161 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.539 ' N ' ' CG ' ' A' ' 161' ' ' ARG . 1.1 p -102.69 24.38 10.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.937 0.399 . . . . 0.0 110.537 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -117.87 -10.76 10.39 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.709 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' A' ' 164' ' ' GLU . 74.9 tt0 -112.1 35.17 3.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.77 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.576 ' O ' ' ND1' ' A' ' 166' ' ' HIS . 3.8 tp -134.8 129.33 51.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.833 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.576 ' ND1' ' O ' ' A' ' 165' ' ' ILE . 12.2 m80 -168.25 25.0 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.331 0.586 . . . . 0.0 109.43 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 45.24 24.04 0.13 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.549 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.447 ' CG ' ' O ' ' A' ' 166' ' ' HIS . 7.2 p30 173.98 110.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.548 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . 0.412 ' O ' ' HB ' ' A' ' 170' ' ' ILE . 56.9 t -139.99 91.14 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.808 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.693 ' O ' HG23 ' A' ' 170' ' ' ILE . 16.2 tt 177.41 98.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.753 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -162.16 156.8 19.17 Favored Pre-proline 0 N--CA 1.454 -0.253 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.212 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.9 108.76 2.79 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.527 2.152 . . . . 0.0 111.97 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.673 ' OG ' ' N ' ' A' ' 177' ' ' ASP . 2.3 t -154.42 135.19 13.65 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.597 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -65.51 -43.38 90.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.46 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.429 HD23 ' C ' ' A' ' 175' ' ' LEU . 2.4 tt -152.5 79.2 1.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.067 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 177' ' ' ASP . 43.9 p 48.02 37.54 7.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.524 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.673 ' N ' ' OG ' ' A' ' 173' ' ' SER . 37.5 t70 58.63 133.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.514 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 11.3 mm -99.79 126.18 53.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.394 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 4.7 tttp -164.51 21.56 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.586 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.51 ' O ' ' O ' ' A' ' 181' ' ' SER . . . 113.96 -138.07 14.6 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.51 ' O ' ' O ' ' A' ' 180' ' ' GLY . 8.7 p 46.86 103.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.875 0.369 . . . . 0.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.46 ' O ' ' HG ' ' A' ' 183' ' ' LEU . 2.5 t -58.93 138.58 19.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.353 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 182' ' ' VAL . 1.6 mt -179.05 -12.76 0.0 OUTLIER 'General case' 0 C--O 1.242 0.662 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.821 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.437 ' ND1' ' N ' ' A' ' 184' ' ' HIS . 2.4 m-70 -58.5 -41.03 84.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.996 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 89.7 p -59.96 -42.89 95.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.817 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.513 ' O ' HD13 ' A' ' 190' ' ' LEU . 42.0 ttm180 -60.9 -45.37 94.88 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.546 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -59.9 -39.61 85.98 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.082 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 58.9 m -61.48 -43.76 98.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.197 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -57.88 -42.11 83.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.971 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.513 HD13 ' O ' ' A' ' 186' ' ' ARG . 10.6 mp -62.27 -45.08 94.87 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.597 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.487 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.11 -39.16 82.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.094 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 5.2 tm-20 -67.97 -46.05 72.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.084 0.469 . . . . 0.0 111.638 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 17.6 pttt -74.6 -44.5 50.39 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.325 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.695 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -67.15 -41.01 86.77 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.939 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.541 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 0.0 OUTLIER -67.27 -35.58 79.79 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.62 ' O ' ' HG3' ' A' ' 199' ' ' GLN . 73.8 m -62.25 -40.74 97.18 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.412 HG23 ' CE1' ' A' ' 145' ' ' HIS . 96.5 mt -66.7 -44.26 89.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.357 0.599 . . . . 0.0 109.723 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -64.18 -47.46 79.74 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.436 0.636 . . . . 0.0 110.389 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.62 ' HG3' ' O ' ' A' ' 196' ' ' SER . 0.0 OUTLIER -64.58 -29.62 70.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.052 179.514 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -64.6 -43.56 96.29 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 201' ' ' LEU . 28.2 mt -63.6 -41.88 98.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.045 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.523 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.0 OUTLIER -64.23 -36.21 83.35 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.368 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.4 -41.86 99.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.508 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 21.9 mt -61.43 -40.54 94.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.294 179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -63.45 -41.13 98.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.959 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.719 ' O ' ' N ' ' A' ' 210' ' ' GLN . 78.9 mtp85 -64.13 -38.94 92.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.288 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.588 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -64.17 -43.11 97.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.024 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 78.0 p -62.97 -37.31 86.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.683 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 24.1 m170 -94.61 -38.46 10.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.379 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.719 ' N ' ' O ' ' A' ' 206' ' ' ARG . 39.6 tt0 -93.89 -32.97 13.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.739 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.588 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -88.84 28.04 6.83 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -59.03 -49.44 77.88 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.69 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.446 ' O ' ' O ' ' A' ' 214' ' ' THR . 1.3 t -178.62 108.62 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.478 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.475 ' O ' ' OE1' ' A' ' 215' ' ' GLU . 7.0 p 52.36 108.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.245 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.478 ' HG3' ' H ' ' A' ' 216' ' ' ALA . 5.8 tp10 -167.42 -166.84 0.82 Allowed 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.171 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . 0.478 ' H ' ' HG3' ' A' ' 215' ' ' GLU . . . 62.59 62.07 1.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.722 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.646 ' O ' ' N ' ' A' ' 219' ' ' GLU . 79.5 mm-40 -147.98 36.96 0.86 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.317 -179.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -42.69 82.73 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 120.598 0.237 . . . . 0.0 110.623 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' A' ' 217' ' ' GLU . 6.1 pt-20 172.36 -25.65 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.765 179.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 221' ' ' PRO . 0.5 OUTLIER -59.31 178.67 0.22 Allowed Pre-proline 0 N--CA 1.466 0.353 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.619 -179.315 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 220' ' ' GLU . 59.3 Cg_endo -84.11 88.42 1.06 Allowed 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.597 2.198 . . . . 0.0 112.801 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -141.25 -105.65 0.15 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.441 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.553 HG13 ' N ' ' A' ' 224' ' ' ILE . 14.9 p -61.74 -46.6 96.17 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 CA-C-O 121.79 0.805 . . . . 0.0 110.046 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.553 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.2 OUTLIER -61.56 -32.86 54.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.672 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . 0.551 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 56.1 t0 -64.25 -40.56 96.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.541 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 4.6 tp -56.04 -42.42 76.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.456 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 27.5 m0 -62.65 -33.92 76.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.736 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . 0.65 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 92.7 m-20 -59.31 -39.12 82.06 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.623 ' N ' HD22 ' A' ' 229' ' ' LEU . 4.1 mm? -65.67 -40.27 92.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.725 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.597 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -25.42 -66.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.301 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.65 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 0.3 OUTLIER -25.48 -87.48 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.726 179.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 58.9 m -79.26 45.95 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.738 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 230' ' ' ALA . . . -139.51 81.59 1.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.835 0.35 . . . . 0.0 110.54 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 60.38 59.54 2.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.374 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.597 HD12 ' O ' ' A' ' 230' ' ' ALA . 76.8 mt -141.13 157.57 45.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.997 0.427 . . . . 0.0 110.783 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 74.8 p -83.34 -162.35 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.674 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 34.9 p-10 -91.75 -53.72 4.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.101 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . 0.549 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 63.8 mttp -61.02 -45.59 94.18 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.25 0.547 . . . . 0.0 110.689 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -62.16 -27.17 68.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.556 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.1 OUTLIER -64.26 -46.1 85.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.589 -179.371 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -66.99 -44.05 81.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.363 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -57.96 -51.1 71.06 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.337 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.456 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.8 OUTLIER -61.97 -45.02 95.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.51 179.424 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 75.4 ttt-85 -51.85 -57.53 9.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.403 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -62.08 -35.54 78.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.675 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.23 -53.02 63.02 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.23 0.538 . . . . 0.0 110.445 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 3.2 mm? -63.21 -41.42 99.14 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.728 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.56 -37.63 78.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.386 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -65.48 -65.01 0.73 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.493 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . 0.565 ' CE2' ' CE1' ' A' ' 307' ' ' HIS . 76.2 m-85 -60.46 -40.75 92.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.701 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.542 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 51.9 tp10 -57.9 -42.04 83.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.285 0.564 . . . . 0.0 109.883 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.33 -35.75 80.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.236 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -60.88 -47.63 85.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.834 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.46 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.2 tt -65.36 -38.13 81.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.174 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.79 -48.36 80.99 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 121.213 0.53 . . . . 0.0 110.468 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.03 -41.46 99.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.065 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . 0.523 ' NE2' ' CD ' ' A' ' 261' ' ' GLN . 0.0 OUTLIER -56.71 -46.16 81.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.955 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . 0.501 ' N ' ' ND1' ' A' ' 257' ' ' HIS . 49.7 t30 -60.13 -40.99 91.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.24 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . 0.457 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 84.6 t60 -57.66 -45.08 86.02 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.258 0.552 . . . . 0.0 109.859 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.02 -37.01 85.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.292 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.523 ' CD ' ' NE2' ' A' ' 257' ' ' HIS . 82.2 mt-30 -58.23 -44.17 88.12 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.205 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.63 -47.25 86.25 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.115 0.483 . . . . 0.0 109.811 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . 0.457 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 5.5 mp0 -65.33 -31.89 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.021 179.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.04 -42.52 99.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.108 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 -65.99 -49.02 69.29 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.142 0.496 . . . . 0.0 110.474 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.62 -43.32 98.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.09 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.25 81.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.083 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -61.14 -48.41 81.76 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.25 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.93 -45.07 95.32 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.132 0.491 . . . . 0.0 110.398 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.15 -39.73 91.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.398 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.35 -43.75 96.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.037 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -60.31 -43.5 96.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.079 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -67.88 -40.76 83.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.826 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.33 86.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.948 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -55.84 -22.62 26.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.455 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 17.2 m -61.83 -39.06 90.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.65 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 77.9 t -60.85 -45.47 98.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.605 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 108.84 -6.79 33.14 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . 0.555 ' O ' HG23 ' A' ' 283' ' ' VAL . 91.4 m-20 -55.34 99.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.81 0.338 . . . . 0.0 110.496 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.7 -40.24 95.71 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.41 -46.32 89.14 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.729 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -68.94 -41.9 77.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.808 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 279' ' ' ASP . 54.6 t -64.35 -45.28 96.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 32.4 m -60.69 -45.86 92.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.058 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.86 -43.82 87.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.537 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 42.3 t -62.42 -43.66 98.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.585 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -64.26 -40.21 95.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.694 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -60.53 -51.49 69.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.162 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -66.02 -34.24 77.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.105 179.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -57.39 -52.05 66.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.601 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.67 -38.41 83.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.676 ' O ' HD12 ' A' ' 292' ' ' LEU . 2.2 tp -61.64 -46.91 87.76 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.237 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 297' ' ' THR . 41.9 tp -64.22 -42.85 96.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.202 0.525 . . . . 0.0 110.102 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.519 ' O ' ' OG1' ' A' ' 297' ' ' THR . 2.3 tm-20 -61.47 -41.2 96.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.79 -42.47 99.75 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 110.636 -0.985 . . . . 0.0 110.636 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -60.76 -43.54 97.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.473 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.519 ' OG1' ' O ' ' A' ' 294' ' ' GLU . 76.7 p -58.97 -47.18 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.076 0.465 . . . . 0.0 110.358 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -62.35 -44.39 96.58 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.488 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -62.43 -37.5 86.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.022 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -44.18 97.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.983 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.51 96.28 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . 0.524 ' OH ' ' NZ ' ' A' ' 306' ' ' LYS . 51.0 t80 -60.82 -45.83 92.93 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.245 0.545 . . . . 0.0 110.372 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.1 m -61.37 -44.75 96.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.461 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.6 t -59.96 -42.24 88.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.112 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -56.82 -54.92 40.89 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.058 0.456 . . . . 0.0 110.663 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . 0.524 ' NZ ' ' OH ' ' A' ' 302' ' ' TYR . 75.4 mttt -61.22 -41.35 96.71 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.19 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.565 ' CE1' ' CE2' ' A' ' 250' ' ' PHE . 2.6 t-80 -64.76 -31.17 72.27 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.26 -48.35 81.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.178 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.62 -42.47 86.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.712 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.9 -47.21 85.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.47 HD11 ' CE1' ' A' ' 307' ' ' HIS . 26.8 mt -64.12 -40.51 96.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.74 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.1 t -59.7 -44.68 93.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.11 61.8 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -62.43 -45.6 92.37 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 4.7 mm -70.34 -40.52 77.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.133 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 11.8 t -44.37 -48.08 9.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.055 0.455 . . . . 0.0 110.156 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.473 ' CD ' ' O ' ' A' ' 319' ' ' ARG . 12.5 ptp85 -94.45 -23.84 17.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.036 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 54.66 51.09 14.52 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.473 ' O ' ' CD ' ' A' ' 317' ' ' ARG . 10.7 mtm-85 178.68 104.36 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.246 0.546 . . . . 0.0 111.775 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . 0.636 ' N ' HD21 ' A' ' 323' ' ' LEU . 25.0 t-80 -155.18 -40.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.331 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.594 ' CG ' ' H ' ' A' ' 322' ' ' GLU . 15.9 p-10 -150.61 -67.8 0.19 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.433 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.594 ' H ' ' CG ' ' A' ' 321' ' ' ASN . 50.0 mt-10 -132.81 74.37 1.57 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.293 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.636 HD21 ' N ' ' A' ' 320' ' ' HIS . 2.1 pt? . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.135 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 40.8 p90 . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 p -151.92 157.09 41.33 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.534 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -107.81 0.55 22.26 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.622 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -116.24 25.55 10.57 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.792 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -62.22 -40.15 95.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.142 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -66.38 155.38 37.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.304 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.783 ' H ' ' CD ' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -158.6 -41.65 0.0 OUTLIER Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.494 -179.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.783 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 25.1 Cg_exo -62.71 145.48 95.02 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 122.835 2.356 . . . . 0.0 112.409 -179.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.2 mtmt -99.09 125.5 41.47 Favored Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.88 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -51.94 -39.63 68.68 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 122.128 1.886 . . . . 0.0 112.222 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.568 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 0.2 OUTLIER -175.01 -44.28 0.0 OUTLIER Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.604 179.582 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.568 ' CD ' ' N ' ' A' ' 11' ' ' SER . 12.7 Cg_exo -67.09 149.42 82.29 Favored 'Trans proline' 0 N--CA 1.51 2.471 0 C-N-CA 123.199 2.599 . . . . 0.0 113.674 -178.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.49 121.0 29.36 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.853 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -64.54 -43.58 93.54 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.865 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -160.31 173.99 14.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.222 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.4 p -69.35 165.52 20.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.417 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -51.63 178.11 0.07 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.566 ' O ' ' N ' ' A' ' 20' ' ' PHE . 79.6 mm-40 -118.4 142.99 46.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.825 0.345 . . . . 0.0 110.368 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.471 ' OE1' ' OD1' ' A' ' 26' ' ' ASN . 94.2 mt-10 46.1 -84.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.094 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.566 ' N ' ' O ' ' A' ' 18' ' ' GLU . 93.9 m-85 -125.26 177.26 6.23 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.807 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -89.61 10.99 21.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.971 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.3 mmm -142.89 141.39 31.51 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 111.062 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -63.86 -35.6 81.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.39 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -59.69 -47.96 83.56 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.017 0.437 . . . . 0.0 110.458 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.65 -37.88 88.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.47 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.471 ' OD1' ' OE1' ' A' ' 19' ' ' GLU . 48.9 t-20 -63.32 -40.72 98.12 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.347 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.61 -44.27 96.73 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.604 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.91 -42.61 99.29 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.049 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -61.56 -43.66 98.45 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.222 0.534 . . . . 0.0 110.459 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -58.4 -44.52 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.047 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.52 -41.32 97.15 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.523 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.93 -44.97 87.24 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.055 0.455 . . . . 0.0 110.224 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.42 -38.03 88.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.285 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -60.3 -43.15 96.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.313 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.9 mt -65.0 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.227 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 66.27 112.13 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.817 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.1 mt -132.43 154.73 81.67 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.798 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -39.41 158.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.396 0 C-N-CA 122.768 2.312 . . . . 0.0 112.264 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -68.72 -46.57 1.7 Allowed 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 122.621 2.214 . . . . 0.0 112.3 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.96 -47.73 91.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.53 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -65.64 -39.2 91.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.349 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.85 -43.65 98.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.712 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -41.54 95.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.421 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -67.17 -45.19 77.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.1 tp -62.98 -49.88 72.95 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.157 0.503 . . . . 0.0 110.641 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -60.96 -40.55 93.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.247 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.64 -40.66 92.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.374 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.07 -47.99 83.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.51 -40.31 96.34 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.543 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -58.29 -45.61 87.61 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.154 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -62.99 -42.61 97.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -51.89 -42.42 62.71 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -64.32 -44.52 91.3 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.783 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' O ' ' HD3' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -61.61 -44.76 96.4 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.44 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -61.27 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.483 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -57.79 -49.14 77.63 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.815 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 83.8 mt -61.27 -42.27 98.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.334 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.53 -46.46 88.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.558 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.418 ' CH2' ' HD2' ' A' ' 63' ' ' LYS . 60.8 t90 -57.75 -40.6 80.09 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -58.74 -46.3 87.71 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.939 179.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -60.67 -44.63 96.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.424 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.409 HD23 ' NZ ' ' A' ' 73' ' ' LYS . 8.1 mp -61.51 -41.47 97.36 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.001 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HD2' ' CH2' ' A' ' 59' ' ' TRP . 87.7 tttt -60.17 -39.27 85.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.683 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.8 tt -61.27 -43.78 98.32 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -71.59 -21.8 61.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.541 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 88.94 15.45 59.34 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 111.291 -0.723 . . . . 0.0 111.291 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.5 mt -63.42 -41.3 98.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.689 0.28 . . . . 0.0 110.767 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.508 ' OD1' ' O ' ' A' ' 68' ' ' ASP . 52.9 p30 -60.53 145.88 46.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.382 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -83.42 -84.98 0.13 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.628 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -115.55 20.8 14.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.97 21.32 50.55 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -57.32 -38.3 73.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.798 0.332 . . . . 0.0 110.278 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.409 ' NZ ' HD23 ' A' ' 62' ' ' LEU . 99.3 mttt -61.35 -45.58 93.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.138 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 tp10 -60.28 -40.28 89.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.004 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.56 91.55 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -62.78 -36.58 83.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.712 ' C ' HD23 ' A' ' 77' ' ' LEU . 7.8 tt -61.78 -47.36 85.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.351 179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -44.85 96.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.269 0.557 . . . . 0.0 109.75 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.56 ' O ' HG23 ' A' ' 83' ' ' VAL . 61.7 ttp180 -57.4 -42.92 83.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.946 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.442 ' O ' HG13 ' A' ' 84' ' ' ILE . 50.4 t30 -62.56 -39.64 94.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.597 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.598 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -58.03 -49.5 76.67 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.765 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -64.0 -39.41 94.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.223 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.1 t -61.49 -45.37 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.454 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.6 mt -59.2 -50.72 78.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.246 -179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.13 -40.9 95.08 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.839 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.63 94.38 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.904 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 47.7 tttp -63.88 -47.94 78.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.629 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.2 -23.3 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.951 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 70.22 27.47 72.8 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt -88.68 -2.23 58.49 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.873 0.368 . . . . 0.0 110.458 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -59.27 -84.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.342 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 125.1 -159.69 19.71 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt 57.45 68.68 0.82 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.816 0.341 . . . . 0.0 110.847 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -63.34 -44.95 93.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.05 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.7 p-10 -167.77 -177.62 3.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.446 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -111.56 129.85 55.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.51 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -167.67 125.04 1.17 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.397 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -150.12 19.97 0.87 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.33 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.7 m -125.49 132.9 70.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.904 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.41 115.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.321 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.1 m -128.58 153.52 47.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.453 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -137.18 129.25 29.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.679 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.0 t -67.15 143.21 56.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.475 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.569 HD12 ' N ' ' A' ' 104' ' ' LEU . 9.7 mp -76.99 149.22 35.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.621 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.3 p 47.3 -84.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.81 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.565 ' N ' ' O ' ' A' ' 104' ' ' LEU . . . 75.22 28.05 62.81 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 20.6 p -97.79 5.8 48.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.792 0.329 . . . . 0.0 110.666 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -63.84 145.23 56.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.649 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -111.15 155.45 22.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.627 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -65.56 -85.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.535 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 144.43 -80.34 0.23 Allowed Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.591 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 14.9 mt -131.64 138.8 48.91 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.815 0.341 . . . . 0.0 111.04 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -91.58 -26.77 18.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.529 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -70.84 123.74 89.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.585 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.83 -24.19 40.62 Favored 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.18 1.92 . . . . 0.0 112.441 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -65.96 -42.93 89.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.626 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.9 mp -85.02 -28.11 25.94 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.8 0.333 . . . . 0.0 110.812 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.616 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 54.2 mt-10 -64.05 -33.94 76.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.978 0.418 . . . . 0.0 110.648 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.591 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 67.9 mmtt -59.79 -46.91 87.74 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.448 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.534 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 31.0 mt -69.09 -47.45 65.2 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.565 ' CE3' HD22 ' A' ' 135' ' ' LEU . 9.7 t-105 -59.71 -48.7 80.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.247 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.616 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 8.7 m-70 -69.68 -31.16 69.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.207 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.591 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 12.9 tptt -57.19 -51.19 70.33 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.806 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.38 -47.23 51.04 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 119.453 -0.899 . . . . 0.0 110.744 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.402 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 48.7 tttm -53.33 -51.03 63.72 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.816 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -74.54 -42.68 58.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.358 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -44.41 -27.81 0.48 Allowed 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -162.28 -96.46 0.11 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 119.609 -1.281 . . . . 0.0 111.506 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.705 ' O ' ' N ' ' A' ' 131' ' ' SER . 57.4 mttp -155.14 24.73 0.42 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.479 ' CD2' ' HB3' ' A' ' 134' ' ' GLU . 3.4 m-30 -59.48 50.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.451 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.705 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.8 m -107.52 113.26 26.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.199 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 120.98 -97.04 0.62 Allowed Glycine 0 CA--C 1.526 0.774 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.828 178.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.491 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 5.6 mp0 -74.41 -43.99 53.87 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.441 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.602 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 51.8 mp0 -63.0 -51.88 65.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.565 HD22 ' CE3' ' A' ' 121' ' ' TRP . 1.6 mt -62.32 -40.26 95.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.935 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -61.66 -41.21 97.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.7 mttt -62.36 -44.05 97.39 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.05 0.452 . . . . 0.0 110.322 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mt -59.53 -43.73 93.38 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.57 ' HA ' ' HB2' ' A' ' 142' ' ' PHE . 0.2 OUTLIER -67.88 -33.82 75.48 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.562 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 71.7 mtp85 -53.93 -45.48 71.25 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 118.866 -1.134 . . . . 0.0 108.131 178.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -71.51 -37.19 71.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.604 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.57 ' HB2' ' HA ' ' A' ' 139' ' ' TRP . 2.6 m-85 -58.64 -58.16 9.78 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.821 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.97 -41.47 98.05 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.413 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.562 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 48.1 m170 -56.02 -42.62 76.76 Favored 'General case' 0 N--CA 1.46 0.065 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.678 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.831 ' O ' HG22 ' A' ' 149' ' ' VAL . 9.5 m-70 -65.82 -39.99 91.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.787 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -59.43 -45.29 91.97 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.257 -179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -71.54 -46.86 58.38 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.625 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 152' ' ' TYR . 68.2 mttm -62.69 -46.04 89.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.751 0.31 . . . . 0.0 111.282 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.831 HG22 ' O ' ' A' ' 145' ' ' HIS . 17.7 m -65.77 -37.85 80.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.597 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.739 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.2 m170 -65.28 -41.58 94.03 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.74 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.82 -45.26 93.44 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.558 ' CE1' ' NZ ' ' A' ' 193' ' ' LYS . 23.1 m-85 -69.54 -47.31 64.12 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.013 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -65.62 -40.79 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.643 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 150' ' ' HIS . 56.6 t -64.05 -43.7 97.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.711 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.32 -44.54 96.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.448 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 18.4 mt -64.24 -43.78 93.85 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.848 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -70.33 -23.52 62.83 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.945 0.403 . . . . 0.0 110.025 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . 0.583 ' O ' ' OG1' ' A' ' 162' ' ' THR . 52.0 m -73.24 -49.94 25.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.983 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.421 HD12 ' N ' ' A' ' 160' ' ' SER . 3.4 pp -76.57 -30.22 56.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.632 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.421 ' N ' HD12 ' A' ' 159' ' ' LEU . 67.5 m -60.66 -48.04 83.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.032 -179.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.499 ' HG3' ' N ' ' A' ' 162' ' ' THR . 19.5 ptp180 -75.42 -45.17 40.47 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.767 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.583 ' OG1' ' O ' ' A' ' 158' ' ' THR . 16.0 p -74.98 170.1 16.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.371 -178.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 65.15 -4.95 0.46 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.11 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.525 ' H ' ' C ' ' A' ' 162' ' ' THR . 97.1 mt-10 -146.25 23.21 1.33 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.342 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.447 ' O ' HG23 ' A' ' 165' ' ' ILE . 15.3 tt -57.47 132.42 21.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.428 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.438 ' O ' ' N ' ' A' ' 168' ' ' ASN . 5.9 t-80 -169.47 23.38 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.547 0.689 . . . . 0.0 109.489 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 167' ' ' GLU . 73.7 tt0 42.89 23.18 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.124 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 166' ' ' HIS . 20.8 t30 174.19 103.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.549 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 56.9 t -127.94 130.58 69.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.471 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.759 ' O ' HG23 ' A' ' 170' ' ' ILE . 20.3 tt -175.37 84.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.9 179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.02 154.91 18.81 Favored Pre-proline 0 N--CA 1.454 -0.253 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.254 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.43 66.68 2.84 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.562 2.175 . . . . 0.0 111.973 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 23.3 t -150.51 149.4 29.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.686 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -111.03 -43.32 3.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.537 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.534 ' O ' HG13 ' A' ' 178' ' ' ILE . 58.8 tp -145.2 98.54 3.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.206 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 31.2 t 62.12 -83.58 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.228 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -164.67 71.12 0.18 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.954 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.731 ' O ' HD12 ' A' ' 178' ' ' ILE . 2.2 pp -131.89 160.74 42.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.651 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.33 -7.48 50.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.252 179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 127.6 89.19 0.65 Allowed Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.57 ' O ' ' NE2' ' A' ' 184' ' ' HIS . 60.4 p -117.85 -40.52 2.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.682 0.277 . . . . 0.0 110.679 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.573 ' C ' ' H ' ' A' ' 184' ' ' HIS . 6.3 t -134.21 160.4 41.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.581 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.429 ' N ' HG12 ' A' ' 182' ' ' VAL . 6.0 tp 65.04 -11.44 0.15 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.689 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.602 ' ND1' ' N ' ' A' ' 184' ' ' HIS . 0.0 OUTLIER -63.93 -46.47 84.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.7 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.476 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 79.0 p -68.01 -40.52 82.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.777 -179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -64.0 -46.66 83.57 Favored 'General case' 0 C--O 1.242 0.707 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.746 -178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . 0.639 ' C ' ' ND1' ' A' ' 187' ' ' HIS . 0.1 OUTLIER -71.44 -34.35 70.18 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.977 179.505 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . 0.625 ' N ' ' ND1' ' A' ' 187' ' ' HIS . 59.6 m -62.26 -44.79 95.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.892 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -61.4 -38.35 86.77 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.552 HD23 ' HE3' ' A' ' 193' ' ' LYS . 10.5 mt -60.96 -41.47 96.39 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.546 -0.462 . . . . 0.0 109.998 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.52 ' HA ' HD23 ' A' ' 194' ' ' LEU . 68.5 mttm -68.19 -35.02 77.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.16 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 86.0 tt0 -67.8 -44.93 76.18 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.153 0.501 . . . . 0.0 111.622 -178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.558 ' NZ ' ' CE1' ' A' ' 152' ' ' TYR . 0.0 OUTLIER -71.87 -38.75 69.99 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.064 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.779 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -65.15 -41.9 94.3 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.969 -0.693 . . . . 0.0 110.351 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 192' ' ' GLU . 18.8 ptp180 -65.27 -38.14 89.36 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . 0.534 ' OG ' ' O ' ' A' ' 193' ' ' LYS . 79.1 p -60.87 -39.03 87.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 194' ' ' LEU . 97.1 mt -63.72 -42.78 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -58.49 -41.52 85.52 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -60.37 -38.6 84.4 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . 0.416 ' O ' ' HB3' ' A' ' 203' ' ' ARG . . . -60.1 -40.3 96.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.428 ' HA ' HD23 ' A' ' 201' ' ' LEU . 19.8 mt -62.16 -40.59 96.51 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.012 -0.675 . . . . 0.0 109.742 178.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -60.31 -37.42 80.51 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 200' ' ' GLY . 5.2 tmm_? -60.84 -41.38 95.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.461 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.18 -38.17 82.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -61.08 -42.54 98.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.284 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 210' ' ' GLN . 5.7 mmp_? -64.48 -36.14 83.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.327 179.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.698 ' O ' ' N ' ' A' ' 211' ' ' GLY . 25.2 t -63.02 -44.95 99.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.194 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.59 -26.79 62.75 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.559 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . 0.426 ' ND1' ' NH1' ' A' ' 206' ' ' ARG . 45.1 t-80 -94.23 -12.93 27.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.372 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.3 tt0 -136.86 -38.33 0.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.093 0.473 . . . . 0.0 110.442 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.698 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -83.4 35.72 2.8 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -45.7 90.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.597 -0.301 . . . . 0.0 110.589 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 32.8 p -158.6 165.24 34.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.361 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.732 HG23 ' H ' ' A' ' 215' ' ' GLU . 0.0 OUTLIER -169.94 -71.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.877 -179.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.732 ' H ' HG23 ' A' ' 214' ' ' THR . 79.3 mm-40 47.38 69.73 0.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.852 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -136.18 140.74 43.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.834 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.607 ' O ' ' N ' ' A' ' 219' ' ' GLU . 77.8 mm-40 -117.79 -12.8 10.18 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 121.034 -0.267 . . . . 0.0 111.671 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.534 ' CG ' ' C ' ' A' ' 217' ' ' GLU . 0.2 OUTLIER 66.03 -57.3 0.35 Allowed 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -177.827 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.607 ' N ' ' O ' ' A' ' 217' ' ' GLU . 37.8 tt0 -125.29 -146.52 0.35 Allowed 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.145 -1.389 . . . . 0.0 108.007 179.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.534 ' H ' ' HG2' ' A' ' 219' ' ' GLU . 16.9 tp10 63.43 125.41 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -48.02 121.21 5.66 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 121.38 1.387 . . . . 0.0 112.811 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 178.69 -102.52 0.0 OUTLIER 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.146 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.489 HG21 HD22 ' A' ' 308' ' ' LEU . 2.6 p -60.62 -48.93 86.51 Favored 'Isoleucine or valine' 0 C--O 1.249 1.035 0 CA-C-O 121.704 0.764 . . . . 0.0 110.763 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.43 ' N ' HG13 ' A' ' 223' ' ' VAL . 0.8 OUTLIER -63.81 -31.47 53.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.438 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 228' ' ' ASP . 51.9 t0 -64.36 -37.99 89.46 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.4 tp -59.44 -42.84 92.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.625 ' CH2' HD23 ' A' ' 308' ' ' LEU . 45.9 m0 -60.36 -36.45 78.06 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.045 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 225' ' ' ASP . 94.0 m-20 -59.43 -40.93 88.33 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.475 ' C ' ' H ' ' A' ' 231' ' ' GLN . 8.8 mp -63.91 -40.67 97.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.321 0.582 . . . . 0.0 109.512 179.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.626 ' O ' HD12 ' A' ' 235' ' ' LEU . . . -53.04 -8.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.846 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.853 ' O ' HD21 ' A' ' 240' ' ' LEU . 11.4 tp-100 -62.86 -43.73 98.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.795 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 54.0 p -145.0 16.48 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.576 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -59.67 -49.86 76.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.697 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . 0.515 ' ND2' ' N ' ' A' ' 234' ' ' ASN . 0.1 OUTLIER 177.54 77.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.595 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.626 HD12 ' O ' ' A' ' 230' ' ' ALA . 96.1 mt -137.19 161.89 34.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.674 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.0 p -72.95 -162.44 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.617 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -92.19 -55.58 3.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -61.93 -41.34 97.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.985 0.421 . . . . 0.0 110.335 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -63.13 -37.72 88.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.853 HD21 ' O ' ' A' ' 231' ' ' GLN . 0.2 OUTLIER -62.81 -43.02 99.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.162 -179.699 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -64.27 -49.44 71.87 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.856 0.36 . . . . 0.0 110.775 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -62.44 -39.77 94.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.978 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.5 ' C ' ' CD1' ' A' ' 243' ' ' PHE . 0.5 OUTLIER -68.01 -42.6 80.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.345 179.089 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . 0.542 ' NH2' ' OE1' ' A' ' 231' ' ' GLN . 59.2 ttm-85 -59.17 -50.17 75.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.976 -178.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.3 -40.61 86.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.791 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -62.07 -46.93 86.95 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.162 0.506 . . . . 0.0 110.415 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 251' ' ' GLU . 1.0 OUTLIER -62.02 -41.68 98.35 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.171 179.49 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -57.04 -42.88 81.3 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.119 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 13.6 m170 -59.42 -55.79 30.22 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.664 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -63.66 -33.85 76.54 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.694 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 29.3 tp10 -59.72 -43.33 94.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.053 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.44 86.65 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.398 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -59.9 -48.17 82.8 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.705 -179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 251' ' ' GLU . 1.3 tt -66.47 -31.76 55.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.272 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.32 -48.87 79.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.186 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.14 -42.25 99.44 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.372 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -57.64 -42.77 84.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.127 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -62.56 -40.43 96.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.356 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . 0.403 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 13.7 t-160 -58.38 -48.06 81.83 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.239 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -62.81 -37.08 85.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.482 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.444 ' NE2' HG21 ' A' ' 297' ' ' THR . 0.3 OUTLIER -59.17 -45.5 90.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.789 0.328 . . . . 0.0 110.435 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -61.73 -45.43 93.99 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . 0.403 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.8 mp0 -64.94 -34.92 79.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.988 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.16 -43.12 99.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.335 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -65.31 -48.22 73.84 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.992 0.425 . . . . 0.0 110.66 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 66.5 mt -63.14 -43.33 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.128 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.07 -36.94 83.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.23 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -63.03 -46.59 86.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.378 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.98 -44.55 95.74 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.453 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.41 -42.87 99.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.465 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.712 ' O ' HD23 ' A' ' 271' ' ' LEU . 2.7 tt -60.72 -43.9 97.28 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.752 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -58.66 -44.75 90.25 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.165 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 -67.75 -36.01 79.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.626 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.408 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.96 -37.11 85.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.009 -179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -58.84 -17.06 20.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.396 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 60.4 p -89.3 2.62 54.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.68 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.544 HG13 ' N ' ' A' ' 278' ' ' GLY . 14.8 p -60.18 -43.48 93.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.677 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.544 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 119.67 -67.86 0.39 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -88.61 116.91 27.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.781 0.324 . . . . 0.0 110.349 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -64.95 116.05 8.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -145.34 -44.62 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.7 0.286 . . . . 0.0 110.408 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -105.76 -6.18 19.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.457 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.55 -45.8 96.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.528 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . 0.418 ' O ' ' HG2' ' A' ' 288' ' ' GLU . 44.5 t -63.49 -51.63 64.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.513 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -61.82 -44.44 96.83 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.981 0.419 . . . . 0.0 110.853 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 38.6 m -60.32 -42.99 96.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.382 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -63.54 -38.33 90.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.933 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 284' ' ' SER . 76.0 mm-40 -59.89 -61.45 2.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.268 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.531 ' HD3' HD23 ' A' ' 292' ' ' LEU . 29.4 mmtt -63.4 -39.71 95.24 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.018 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 15.8 t-80 -45.16 -55.41 5.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.938 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -65.43 -35.69 81.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.679 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.531 HD23 ' HD3' ' A' ' 289' ' ' LYS . 16.5 tp -60.63 -49.04 79.14 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.497 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.67 -41.52 98.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 109.973 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 295' ' ' GLY . 0.1 OUTLIER -63.92 -39.94 95.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . 0.401 ' N ' ' HG2' ' A' ' 294' ' ' GLU . . . -59.99 -50.78 63.99 Favored Glycine 0 CA--C 1.52 0.383 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 -179.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . 0.433 ' CZ ' ' OE1' ' A' ' 299' ' ' GLU . 10.6 tpp180 -60.4 -37.79 81.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.909 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.444 HG21 ' NE2' ' A' ' 261' ' ' GLN . 9.1 m -58.91 -48.15 82.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.327 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -63.59 -41.53 98.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.729 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . 0.433 ' OE1' ' CZ ' ' A' ' 296' ' ' ARG . 96.6 mt-10 -58.77 -43.82 90.49 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.138 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.5 -43.99 97.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.393 -0.523 . . . . 0.0 109.906 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.75 -41.9 84.07 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -61.16 -45.88 92.83 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.145 0.498 . . . . 0.0 110.455 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 19.5 m -60.14 -43.37 95.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.313 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.36 -43.12 93.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.052 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -58.66 -46.12 87.85 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.805 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -62.99 -42.86 99.96 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.559 179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -65.42 -35.42 80.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.137 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.625 HD23 ' CH2' ' A' ' 227' ' ' TRP . 21.7 mt -62.29 -43.58 98.5 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.362 179.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 19.5 tm0? -65.49 -46.52 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -64.31 -49.02 73.43 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.079 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 33.1 mt -62.86 -42.78 99.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 51.0 m -60.95 -41.87 97.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.299 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.48 98.22 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.3 -47.99 79.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.773 0.32 . . . . 0.0 110.74 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.481 ' O ' ' C ' ' A' ' 316' ' ' SER . 17.0 mt -77.71 -25.4 14.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.067 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 315' ' ' ILE . 42.6 t -33.1 -54.59 0.39 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.742 -179.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.504 HH12 ' CD2' ' A' ' 323' ' ' LEU . 18.2 ptt85 -106.31 -32.6 8.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.484 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 44.0 58.47 3.64 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.063 0.458 . . . . 0.0 109.824 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 54.0 ptt85 -56.77 177.57 0.07 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.323 -179.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -70.62 134.2 47.37 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.097 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 75.27 150.63 0.11 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.042 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -46.48 137.57 6.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.629 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.504 ' CD2' HH12 ' A' ' 317' ' ' ARG . 9.8 mp . . . . . 0 C--O 1.219 -0.523 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.467 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 p -78.4 -4.88 50.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.603 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -62.98 -38.86 92.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.485 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -68.28 143.68 55.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.533 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -126.37 134.9 50.94 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.487 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 57.03 36.06 27.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.431 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.603 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -64.63 -41.14 55.36 Favored Pre-proline 0 C--O 1.231 0.123 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.244 -179.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 7' ' ' GLN . 35.1 Cg_exo -59.52 142.6 99.17 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.41 2.073 . . . . 0.0 112.078 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -155.43 149.97 20.06 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.316 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.38 155.45 63.88 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.671 2.247 . . . . 0.0 111.966 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -156.16 64.24 3.66 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.807 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.45 -14.81 22.48 Favored 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 122.751 2.301 . . . . 0.0 112.117 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt 72.56 36.64 0.97 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.627 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -61.93 -41.71 98.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.594 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 62.47 129.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.375 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.2 t -150.08 154.21 37.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.441 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -87.09 129.4 9.46 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -175.51 76.07 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.64 0.257 . . . . 0.0 110.426 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.436 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 55.6 mp0 -70.86 -41.26 71.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.027 0.441 . . . . 0.0 110.841 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -119.87 164.15 16.46 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.778 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -81.1 -15.43 55.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.936 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.04 145.85 51.15 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 121.401 0.62 . . . . 0.0 111.166 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -64.99 -36.51 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.363 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.1 tttp -57.57 -47.93 80.76 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.276 0.56 . . . . 0.0 110.466 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.3 mt -60.8 -39.47 89.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.344 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -63.47 -39.84 95.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -57.41 -48.91 77.86 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.373 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 28' ' ' LEU . 4.2 mm? -61.38 -42.82 99.33 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.23 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.501 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 46.5 t-105 -61.48 -42.35 98.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.266 0.555 . . . . 0.0 110.417 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -57.72 -44.6 86.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.403 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.8 -41.57 95.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.356 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.27 93.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.428 . . . . 0.0 110.427 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.501 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 77.5 mt-30 -62.46 -39.42 93.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.329 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.24 -40.92 97.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.361 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.02 -39.86 95.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.429 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.64 106.94 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.896 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -129.45 155.06 80.73 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -40.47 154.33 0.06 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.65 2.233 . . . . 0.0 112.245 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.93 -36.07 32.35 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.594 2.196 . . . . 0.0 112.296 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.73 -49.77 75.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.017 0.437 . . . . 0.0 110.747 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -68.25 -39.29 82.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.464 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -63.03 -43.41 98.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.88 -43.67 87.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.634 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.57 -44.26 74.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.765 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.63 -48.4 79.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.565 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -60.88 -41.63 96.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.35 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.622 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.69 -48.79 79.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.734 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -56.37 -47.92 77.9 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.536 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.64 -39.25 83.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.075 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.98 -38.07 84.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.95 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 47' ' ' ALA . 38.6 mm -62.92 -44.38 99.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.899 179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -58.31 -43.64 88.23 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.332 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -60.52 -47.48 85.98 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.171 0.51 . . . . 0.0 110.322 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -62.59 -41.33 98.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.693 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -63.87 -37.33 86.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.301 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -62.63 -46.99 85.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.103 0.477 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.1 tp -61.4 -41.32 96.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.995 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.04 -41.99 99.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.532 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 61.9 t90 -58.96 -43.35 91.3 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.924 0.393 . . . . 0.0 110.275 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.78 -45.87 92.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -57.75 -42.42 83.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.997 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.4 mt -62.53 -42.34 99.46 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.016 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -56.48 -43.65 79.85 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.63 -39.68 94.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.879 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -63.22 -21.56 66.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.988 179.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.75 35.63 3.98 Favored Glycine 0 C--N 1.335 0.473 0 N-CA-C 111.233 -0.747 . . . . 0.0 111.233 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 90.9 mt -123.25 -164.99 1.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.339 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 54.63 95.11 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.521 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -121.67 -39.93 2.59 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.619 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -62.2 -41.17 98.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.643 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 88.41 6.93 73.32 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -60.48 -39.18 86.71 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.345 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.518 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 3.4 mptp? -54.79 -55.87 25.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.914 0.388 . . . . 0.0 110.52 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -57.84 -39.89 78.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.021 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.53 -41.38 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.54 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.518 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 89.7 mtm180 -65.16 -39.98 93.7 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.69 -44.91 92.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.392 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.53 -45.14 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.238 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.493 ' O ' HG23 ' A' ' 83' ' ' VAL . 73.4 ttt180 -60.63 -43.24 97.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.128 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.455 ' OD1' HD11 ' A' ' 84' ' ' ILE . 26.0 t-20 -64.06 -40.13 95.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.58 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.688 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -59.45 -46.68 88.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.045 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -64.92 -39.87 94.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.588 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.8 t -63.75 -46.5 94.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.432 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.455 HD11 ' OD1' ' A' ' 80' ' ' ASN . 96.6 mt -60.13 -49.88 82.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.558 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' A' ' 85' ' ' LEU . 19.3 mt -65.09 -40.69 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.062 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.01 -41.1 97.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.795 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -64.77 -46.78 80.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.775 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -76.05 -19.59 58.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.394 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 65.29 26.53 71.7 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 89.9 mt -97.65 13.42 30.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 110.669 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 92' ' ' GLY . 38.4 p-10 -62.77 -37.64 87.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.69 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.51 ' N ' ' OD1' ' A' ' 91' ' ' ASP . . . 119.47 159.39 10.95 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -138.03 124.39 20.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.912 0.387 . . . . 0.0 110.397 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -144.12 150.53 38.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.89 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.459 ' OD1' ' N ' ' A' ' 96' ' ' ALA . 65.3 t0 -72.32 131.33 42.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.608 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.459 ' N ' ' OD1' ' A' ' 95' ' ' ASP . . . -108.72 125.25 51.7 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.228 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -121.32 -9.72 9.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.854 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -75.64 127.98 34.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.606 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 71.0 t -62.85 -46.87 95.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.738 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.1 t -155.95 153.24 29.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.66 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 66.8 m -105.9 114.62 28.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.284 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -105.1 1.11 28.12 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.653 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 83.9 p -65.9 135.24 54.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.374 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 104' ' ' LEU . 10.9 mp 44.52 66.59 0.83 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.211 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.7 t -63.28 -43.19 98.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.73 -179.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 68.83 95.2 0.05 OUTLIER Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 13.1 p -100.72 0.35 38.78 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.736 0.303 . . . . 0.0 110.775 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 57.45 160.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.563 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -148.89 159.28 44.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.636 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.479 ' CG ' ' H ' ' A' ' 111' ' ' GLY . 26.4 t0 -145.57 -172.65 3.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.633 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.479 ' H ' ' CG ' ' A' ' 110' ' ' ASP . . . -62.06 -51.79 54.48 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.517 ' H ' HD12 ' A' ' 112' ' ' LEU . 0.0 OUTLIER -127.12 48.0 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.879 0.371 . . . . 0.0 110.498 -179.732 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.412 ' N ' ' OD1' ' A' ' 113' ' ' ASP . 31.5 p-10 -65.16 -27.75 68.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.444 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -99.39 147.77 33.77 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.452 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.452 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 35.1 Cg_endo -64.79 -24.1 61.95 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.619 2.213 . . . . 0.0 111.87 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.636 ' CZ ' HH21 ' A' ' 205' ' ' ARG . 76.9 ttt-85 -62.98 -46.07 89.45 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.947 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.56 -39.55 77.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.954 0.407 . . . . 0.0 110.663 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.538 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 98.3 mt-10 -60.51 -39.24 87.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.521 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.572 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 97.4 mttt -61.0 -44.2 97.77 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.494 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.75 -46.54 84.85 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.943 0.402 . . . . 0.0 111.71 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.587 ' CE2' HD13 ' A' ' 135' ' ' LEU . 8.7 t-105 -60.0 -47.54 85.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.369 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.538 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 9.9 m-70 -71.17 -32.97 69.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.429 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.572 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 0.8 OUTLIER -56.59 -51.02 70.21 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.86 -178.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.63 -46.74 58.22 Favored 'General case' 0 C--O 1.247 0.936 0 C-N-CA 120.017 -0.673 . . . . 0.0 110.596 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -52.97 -45.21 67.69 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.914 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 6.7 m -85.41 -40.94 15.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.691 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.557 ' OG ' ' O ' ' A' ' 123' ' ' LYS . 13.7 m -44.54 -29.88 0.79 Allowed 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -155.36 -96.59 0.13 Allowed Glycine 0 N--CA 1.463 0.472 0 C-N-CA 119.751 -1.214 . . . . 0.0 111.31 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.731 ' O ' ' N ' ' A' ' 131' ' ' SER . 65.1 mttp -154.51 17.58 0.47 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -57.93 51.04 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.811 -179.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.731 ' N ' ' O ' ' A' ' 129' ' ' LYS . 5.5 m -109.13 123.54 49.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.139 0.495 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.61 -97.8 1.2 Allowed Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.142 178.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -74.96 -39.87 61.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.993 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.401 ' O ' HD23 ' A' ' 138' ' ' LEU . 58.5 mp0 -63.45 -52.71 60.28 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.067 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.587 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.3 mt -59.8 -39.96 86.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.352 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -61.82 -38.66 88.99 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -63.1 -42.89 99.66 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.444 0.64 . . . . 0.0 109.854 178.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 138' ' ' LEU . 4.2 mm? -59.45 -42.55 92.23 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.21 -37.57 87.94 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -53.54 -41.16 66.15 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 178.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.931 ' O ' ' ND1' ' A' ' 144' ' ' HIS . 79.9 mm-40 -69.66 -47.32 63.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -57.42 -48.75 78.29 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.2 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 143' ' ' LEU . 95.2 mt -59.76 -41.33 90.78 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.071 -0.651 . . . . 0.0 110.205 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.931 ' ND1' ' O ' ' A' ' 141' ' ' GLU . 1.8 p-80 -55.84 -43.03 76.65 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.024 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.706 ' N ' ' CD2' ' A' ' 144' ' ' HIS . 11.9 m-70 -59.8 -41.98 92.42 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.449 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -62.65 -42.44 99.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.313 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.718 ' O ' ' CD2' ' A' ' 150' ' ' HIS . 96.5 mt-10 -67.59 -44.09 78.95 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.206 0.527 . . . . 0.0 111.297 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.47 -42.24 71.71 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.574 -0.451 . . . . 0.0 111.146 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.99 -50.56 76.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.828 ' O ' HG23 ' A' ' 154' ' ' VAL . 0.2 OUTLIER -72.75 -18.89 61.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.711 -0.796 . . . . 0.0 110.25 -179.642 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.671 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 9.7 mm-40 -70.89 -48.69 52.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.528 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 29.2 m-85 -63.77 -41.22 98.02 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.767 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -64.85 -38.46 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.938 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.828 HG23 ' O ' ' A' ' 150' ' ' HIS . 19.3 t -61.25 -46.28 96.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.265 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.1 mt -65.28 -44.88 86.58 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.814 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -64.31 -43.81 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.064 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' A' ' 154' ' ' VAL . 0.6 OUTLIER -68.68 -29.67 68.17 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.103 0.477 . . . . 0.0 109.982 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 154' ' ' VAL . 66.1 m -65.36 -48.69 72.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.811 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.769 HD22 HH22 ' A' ' 186' ' ' ARG . 2.3 pp -79.11 -21.12 47.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.762 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.434 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 95.7 p -65.38 -35.88 82.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.826 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -61.97 -46.36 89.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.293 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.699 ' C ' ' H ' ' A' ' 164' ' ' GLU . 2.9 t -100.49 174.22 6.2 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.442 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 62.41 -16.36 0.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.962 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.699 ' H ' ' C ' ' A' ' 162' ' ' THR . 59.3 tt0 -111.38 43.64 1.46 Allowed 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.662 179.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.7 tt -134.57 140.45 45.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.066 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.435 ' O ' ' CG ' ' A' ' 167' ' ' GLU . 19.6 t-80 -176.19 24.21 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.435 ' CG ' ' O ' ' A' ' 166' ' ' HIS . 14.3 pt-20 43.3 31.13 0.36 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.891 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -165.78 -66.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.338 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 4.4 t 47.46 71.67 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.739 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.504 ' O ' HG23 ' A' ' 170' ' ' ILE . 20.5 tt -177.49 126.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.626 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -162.89 165.44 14.94 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.272 179.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.39 139.76 64.3 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.511 2.141 . . . . 0.0 111.952 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 1.6 p -145.96 138.1 25.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.418 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -129.03 -32.64 2.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.517 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 178' ' ' ILE . 51.9 tp -63.06 101.32 0.27 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.509 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.628 ' O ' ' CG ' ' A' ' 177' ' ' ASP . 0.9 OUTLIER 43.57 35.0 0.89 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.257 179.505 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.628 ' CG ' ' O ' ' A' ' 176' ' ' SER . 4.8 p-10 49.63 24.6 1.22 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.553 ' C ' HD12 ' A' ' 178' ' ' ILE . 2.6 pp -132.95 165.93 30.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.105 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -113.25 131.24 55.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.42 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 140.36 142.65 4.21 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 39.9 t -93.05 -43.46 8.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 110.896 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.652 HG12 ' O ' ' A' ' 182' ' ' VAL . 60.3 t -129.13 8.15 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.983 0.421 . . . . 0.0 110.825 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 183' ' ' LEU . 12.0 tp -52.08 -7.11 0.05 Allowed 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.262 0.553 . . . . 0.0 110.875 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.54 ' ND1' ' N ' ' A' ' 184' ' ' HIS . 0.2 OUTLIER -56.35 -39.09 72.31 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.155 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 58.7 p -60.83 -42.34 97.54 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.053 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.769 HH22 HD22 ' A' ' 159' ' ' LEU . 3.0 tpt180 -62.08 -45.3 94.11 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 120.926 0.393 . . . . 0.0 110.642 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -65.69 -38.44 89.26 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.326 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 61.6 m -60.68 -44.85 96.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.073 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.455 ' O ' ' CD ' ' A' ' 193' ' ' LYS . 97.5 mt-10 -61.2 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.077 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.468 ' HA ' ' HD3' ' A' ' 193' ' ' LYS . 3.5 mt -61.23 -42.05 97.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.351 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 98.3 mttt -68.84 -29.36 67.67 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 76.3 tt0 -69.94 -50.97 36.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.978 0.418 . . . . 0.0 111.629 -179.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.528 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 1.1 ptmt -71.94 -39.41 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.783 -0.367 . . . . 0.0 111.247 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.795 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -70.45 -41.45 72.82 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.93 -179.493 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.518 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 50.2 ptt85 -65.87 -37.46 86.2 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 96.0 p -62.73 -41.45 99.19 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 193' ' ' LYS . 91.9 mt -65.72 -43.69 93.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.824 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -63.51 -41.27 98.51 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.685 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.855 ' O ' ' OD1' ' A' ' 202' ' ' ASP . 47.1 mm-40 -63.5 -33.02 74.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.207 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -67.57 -40.6 90.73 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 201' ' ' LEU . 37.3 mt -63.74 -43.34 96.76 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.205 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.904 ' OD1' ' N ' ' A' ' 203' ' ' ARG . 9.1 p-10 -65.82 -34.23 77.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.595 0.712 . . . . 0.0 109.213 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.904 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 3.1 tmt_? -63.43 -42.6 98.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.375 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 204' ' ' LEU . 49.4 mt -61.18 -39.78 91.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.636 HH21 ' CZ ' ' A' ' 116' ' ' ARG . 33.6 mmt180 -60.19 -43.1 96.19 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.045 179.337 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.611 ' O ' ' N ' ' A' ' 210' ' ' GLN . 94.8 mtm-85 -64.76 -36.79 85.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.391 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.67 ' O ' ' N ' ' A' ' 211' ' ' GLY . 47.2 t -63.17 -46.46 95.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.041 0.448 . . . . 0.0 110.176 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.7 p -74.24 -26.64 60.35 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.928 0.394 . . . . 0.0 110.764 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -95.05 -14.37 24.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.292 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.611 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -138.11 -30.19 0.81 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.043 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.67 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -73.18 15.49 2.49 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.463 ' H ' ' C ' ' A' ' 210' ' ' GLN . 2.5 t80 -64.09 -63.16 1.22 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.967 0.413 . . . . 0.0 110.604 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.451 ' O ' ' OG ' ' A' ' 213' ' ' SER . 0.5 OUTLIER 174.75 81.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.273 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 7.0 p -104.22 -11.88 16.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.63 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 55.68 177.88 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.501 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -106.82 170.21 8.08 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.918 0.39 . . . . 0.0 111.15 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -143.08 30.98 1.4 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.987 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.49 ' O ' ' C ' ' A' ' 219' ' ' GLU . 70.2 m-85 -84.03 157.51 21.79 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.498 0.666 . . . . 0.0 109.687 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.49 ' C ' ' O ' ' A' ' 218' ' ' PHE . 81.9 tt0 -34.59 -48.16 0.35 Allowed 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.114 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.86 ' O ' HG12 ' A' ' 223' ' ' VAL . 39.5 tp10 -174.01 126.77 0.44 Allowed Pre-proline 0 C--O 1.225 -0.19 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.811 176.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.631 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 72.6 Cg_exo -43.42 159.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.377 2.051 . . . . 0.0 111.755 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.631 ' CB ' ' O ' ' A' ' 221' ' ' PRO . 65.8 ttp85 95.74 -54.44 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.619 0.575 . . . . 0.0 110.705 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 1.007 HG13 ' H ' ' A' ' 224' ' ' ILE . 4.9 p -55.91 -83.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.24 0.598 0 CA-C-O 121.351 0.596 . . . . 0.0 110.878 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 1.007 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.9 OUTLIER -57.1 -24.58 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.036 -179.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -64.36 -47.55 78.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.096 0.474 . . . . 0.0 109.731 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.433 HD23 HD12 ' A' ' 229' ' ' LEU . 24.1 mt -61.35 -42.82 99.31 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.77 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.493 ' HB3' HD11 ' A' ' 247' ' ' LEU . 43.6 m0 -60.88 -36.17 78.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.983 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . 0.404 ' OD1' ' O ' ' A' ' 228' ' ' ASP . 64.8 t0 -63.74 -38.3 90.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.663 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 231' ' ' GLN . 95.0 mt -62.62 -42.18 99.43 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.1 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.403 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -38.12 -25.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.095 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 229' ' ' LEU . 7.2 tt0 -69.65 -72.47 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.805 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 79.1 p -66.18 -18.49 65.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -57.4 -53.88 53.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.876 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . 0.714 ' ND2' HH21 ' A' ' 319' ' ' ARG . 48.5 t-20 -178.79 -143.11 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.046 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.64 ' H ' ' CG ' ' A' ' 234' ' ' ASN . 36.7 mt 80.32 144.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.661 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 24.1 p -80.57 172.47 13.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 33.0 p-10 -55.86 -44.12 77.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.638 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . 0.467 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 99.0 mttt -62.6 -47.99 81.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.011 0.434 . . . . 0.0 110.662 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -65.85 -36.11 82.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.68 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.755 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.46 -43.12 98.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.196 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -62.9 -48.97 76.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.477 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -60.17 -48.69 80.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.504 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.4 OUTLIER -63.64 -39.72 95.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.323 179.283 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -57.44 -50.32 73.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.961 0.41 . . . . 0.0 110.528 -179.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.61 -36.26 83.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.563 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -60.13 -51.87 67.77 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.51 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.51 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.4 mm? -63.12 -40.38 97.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.886 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 79.3 tttt -55.65 -45.4 77.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.196 0.522 . . . . 0.0 110.337 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.86 -37.03 81.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.288 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -61.23 -49.33 77.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.065 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 11.9 pt-20 -62.83 -37.08 85.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.058 0.456 . . . . 0.0 109.851 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.77 -38.83 87.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.617 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -63.53 -48.97 75.36 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.245 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 10.5 tt -64.2 -34.17 67.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.26 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -63.05 -48.34 79.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.053 0.454 . . . . 0.0 110.399 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.217 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -55.75 -43.2 76.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.029 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -61.83 -40.47 95.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.088 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -59.16 -47.83 83.85 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.249 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -64.24 -32.91 74.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.378 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -48.69 80.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.861 0.363 . . . . 0.0 110.186 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -61.93 -43.54 98.64 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.27 -36.85 85.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.002 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 41.6 tp -62.4 -42.47 99.45 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.137 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -62.41 -46.05 90.34 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.381 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 88.0 mt -62.51 -43.48 98.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.3 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.2 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.39 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -61.28 -46.96 88.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.211 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -61.93 -46.15 90.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.37 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -62.0 -39.2 91.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.52 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.661 ' O ' HD23 ' A' ' 271' ' ' LEU . 1.3 tt -60.11 -44.16 95.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.887 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -63.08 -40.19 96.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.271 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -67.33 -41.61 84.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.759 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.747 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.6 -41.92 99.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.82 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -56.95 -17.56 10.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.94 0.4 . . . . 0.0 110.539 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 3.6 t -62.6 -34.09 76.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.542 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.838 HG13 ' H ' ' A' ' 279' ' ' ASP . 8.4 p -59.16 -40.03 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.323 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 64.94 26.93 71.6 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . 0.838 ' H ' HG13 ' A' ' 277' ' ' VAL . 25.6 t0 -108.19 -8.8 15.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.318 . . . . 0.0 110.556 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . 0.62 ' C ' ' H ' ' A' ' 282' ' ' ARG . . . 63.99 -141.64 45.28 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 281' ' ' GLU . 78.2 tt0 58.56 -5.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . 0.62 ' H ' ' C ' ' A' ' 280' ' ' GLY . 41.9 ttm180 -140.02 -31.07 0.66 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.516 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.83 -44.07 98.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.418 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 39.6 t -60.78 -53.15 60.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.08 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 74.0 mtp85 -60.82 -46.63 89.79 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.913 0.387 . . . . 0.0 111.064 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 19.6 m -59.1 -40.24 84.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -65.78 -39.38 90.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.547 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -58.7 -59.65 5.07 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.28 0.562 . . . . 0.0 110.429 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.607 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.5 mmtm -63.23 -35.84 81.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.309 179.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -52.16 -49.04 64.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.045 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.66 -31.93 70.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.258 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.607 HD23 ' HD3' ' A' ' 289' ' ' LYS . 16.8 tp -64.25 -53.29 51.46 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.51 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.0 mp -63.6 -41.53 98.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.012 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -64.77 -39.57 93.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.169 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.15 -45.43 96.57 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . 0.653 ' C ' ' HE ' ' A' ' 296' ' ' ARG . 1.4 tmm_? -63.63 -41.88 98.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.058 0.456 . . . . 0.0 110.14 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 9.1 m -58.45 -49.59 76.78 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.47 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -40.13 96.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.417 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -58.48 -42.67 88.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -44.31 96.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.919 0.39 . . . . 0.0 110.462 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.28 -45.42 92.77 Favored Glycine 0 CA--C 1.528 0.861 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -62.11 -41.76 98.55 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.098 0.475 . . . . 0.0 110.463 179.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 14.5 m -61.1 -43.97 98.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.502 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -60.03 -43.21 92.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.96 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -59.16 -48.97 79.63 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.196 0.522 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -61.74 -44.8 96.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.226 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.581 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.8 OUTLIER -63.36 -36.05 82.42 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.471 ' O ' ' OG ' ' A' ' 312' ' ' SER . 0.4 OUTLIER -58.0 -45.42 86.85 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.413 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -71.66 -57.63 4.21 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.272 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.34 -49.58 76.41 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.55 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 307' ' ' HIS . 4.4 tp -61.55 -43.03 99.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.506 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 308' ' ' LEU . 51.8 p -60.0 -40.54 89.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.15 -38.27 95.06 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.24 -45.0 95.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.78 0.324 . . . . 0.0 110.659 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.657 ' O ' ' N ' ' A' ' 318' ' ' ALA . 4.1 mm -61.0 -100.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.454 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . 0.53 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.4 m 30.54 -87.11 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.309 0.576 . . . . 0.0 110.264 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.741 ' HG3' ' H ' ' A' ' 319' ' ' ARG . 11.4 ptp85 -59.19 -44.17 92.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.46 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.657 ' N ' ' O ' ' A' ' 315' ' ' ILE . . . 77.45 12.96 1.98 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.44 178.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.741 ' H ' ' HG3' ' A' ' 317' ' ' ARG . 94.9 mtt180 -147.72 115.28 6.34 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.137 0.494 . . . . 0.0 111.761 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -157.73 -50.69 0.07 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.319 179.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -135.57 -79.71 0.43 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.208 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -133.5 51.69 2.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.714 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.972 HD13 ' O ' ' A' ' 323' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.217 -0.644 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.419 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 86.8 t80 . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.2 p -67.62 -48.15 67.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.099 -179.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -138.44 151.54 47.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.433 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -114.44 103.04 10.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.248 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -61.6 -38.55 88.02 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.189 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -90.19 142.9 27.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.418 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.837 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -165.35 -45.01 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.823 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.837 ' HD2' ' H ' ' A' ' 7' ' ' GLN . 87.4 Cg_endo -79.99 149.81 20.34 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 122.37 2.047 . . . . 0.0 112.215 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -148.95 146.58 21.87 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.062 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -63.49 147.03 93.46 Favored 'Trans proline' 0 N--CA 1.501 1.941 0 C-N-CA 122.333 2.022 . . . . 0.0 112.048 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.4 p -151.85 140.9 13.92 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.09 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -69.51 148.57 66.99 Favored 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 122.554 2.169 . . . . 0.0 112.42 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -102.89 109.65 21.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.639 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.523 ' O ' ' O ' ' A' ' 15' ' ' GLU . 61.3 ttp180 -138.84 115.33 10.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.263 179.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.523 ' O ' ' O ' ' A' ' 14' ' ' ARG . 78.9 tt0 56.2 132.92 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.911 0.386 . . . . 0.0 110.573 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.5 t -57.55 -95.25 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.473 ' C ' ' OE1' ' A' ' 18' ' ' GLU . . . 80.05 -164.47 48.14 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.473 ' OE1' ' C ' ' A' ' 17' ' ' GLY . 58.6 mp0 48.58 100.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.742 0.305 . . . . 0.0 110.513 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.586 ' H ' HD21 ' A' ' 26' ' ' ASN . 80.2 mm-40 -103.75 -15.01 15.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.788 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -132.7 152.07 51.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.774 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -67.25 -18.77 65.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.88 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.4 mmt -129.6 148.05 51.46 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.295 0.569 . . . . 0.0 111.116 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.669 ' OE1' ' N ' ' A' ' 23' ' ' GLU . 49.7 mp0 -66.42 -40.94 89.86 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.698 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -56.01 -47.79 77.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.121 0.486 . . . . 0.0 110.469 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 25' ' ' LEU . 94.8 mt -61.59 -39.41 91.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.295 0.569 . . . . 0.0 109.506 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.586 HD21 ' H ' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -64.24 -40.25 95.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.185 179.549 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -60.48 -42.71 96.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.209 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.88 -43.8 98.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.944 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.577 ' CD1' ' NE2' ' A' ' 33' ' ' GLN . 56.7 t-105 -61.8 -44.01 97.71 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.293 0.568 . . . . 0.0 110.369 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -56.66 -42.6 79.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.103 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.24 -42.93 99.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.205 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.73 -41.25 90.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.99 0.424 . . . . 0.0 110.274 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.577 ' NE2' ' CD1' ' A' ' 29' ' ' TRP . 73.8 mt-30 -58.79 -47.29 85.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.184 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -63.56 -34.77 78.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.19 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 35' ' ' LEU . 14.4 tp -62.43 -36.64 83.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.284 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.569 ' CD2' ' O ' ' A' ' 33' ' ' GLN . 35.7 m170 65.89 110.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.074 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -134.74 154.19 79.3 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.74 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -40.61 153.92 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 122.562 2.174 . . . . 0.0 112.423 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -61.86 -50.2 5.59 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.682 2.255 . . . . 0.0 112.457 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.27 -47.82 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.575 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.4 ' NH2' ' CZ ' ' A' ' 88' ' ' TYR . 64.8 ttt-85 -63.24 -39.47 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.083 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.89 -44.42 96.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.716 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.63 94.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.401 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.58 -44.99 69.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.449 HD13 ' OH ' ' A' ' 88' ' ' TYR . 44.3 tp -63.46 -46.87 84.24 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -62.09 -42.27 99.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.37 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.29 90.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.457 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -59.71 -52.56 64.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.495 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.51 -39.73 94.45 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.2 0.524 . . . . 0.0 110.378 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.3 -45.53 87.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.016 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.61 -42.68 96.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.822 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -52.28 -42.93 64.13 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -64.86 -41.31 95.79 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -61.63 -46.71 88.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.241 0.543 . . . . 0.0 110.586 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -63.28 -35.7 81.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.485 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.41 ' OE1' ' C ' ' A' ' 56' ' ' GLU . 10.4 tm-20 -58.14 -47.66 82.65 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.985 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 57' ' ' LEU . 30.7 mt -62.31 -42.38 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.305 179.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.03 -44.36 96.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.477 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 81.5 t90 -59.14 -41.63 88.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -60.16 -45.89 91.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -58.39 -43.28 88.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.977 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -61.91 -39.41 91.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.26 -0.576 . . . . 0.0 109.851 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.35 -41.96 90.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.71 -43.93 97.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.056 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -73.56 -22.44 60.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.18 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 87.36 13.24 66.03 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.8 mt -64.33 -41.64 96.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.69 0.281 . . . . 0.0 111.003 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -86.56 116.44 24.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.563 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -129.8 -31.73 1.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.414 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -63.05 -41.81 99.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.77 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 74' ' ' GLU . . . 89.02 2.76 77.41 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -68.15 -34.25 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.859 0.362 . . . . 0.0 110.622 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.5 mttt -59.03 -59.05 6.09 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.71 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 71' ' ' GLY . 13.5 pt-20 -58.76 -39.23 80.39 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.043 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.403 ' N ' ' HG3' ' A' ' 74' ' ' GLU . . . -58.75 -41.43 86.48 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.406 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -64.95 -41.2 95.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.9 0.381 . . . . 0.0 110.07 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.27 -43.9 93.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.253 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 94.2 mt -64.24 -47.49 89.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.07 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.675 ' O ' HG23 ' A' ' 83' ' ' VAL . 10.3 tpp180 -60.42 -44.21 95.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.194 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.436 ' O ' HG13 ' A' ' 84' ' ' ILE . 44.9 t30 -61.91 -41.04 97.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.511 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.61 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -58.01 -50.13 74.48 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.129 -179.427 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -64.93 -37.17 86.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.32 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 79' ' ' ARG . 59.0 t -63.78 -45.96 95.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.442 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 80' ' ' ASN . 97.0 mt -59.01 -51.23 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.464 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.419 HD21 ' HA ' ' A' ' 91' ' ' ASP . 12.7 tp -66.63 -40.36 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.788 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.56 79.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.966 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.7 tttp -61.4 -47.94 83.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.55 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.449 ' OH ' HD13 ' A' ' 45' ' ' LEU . 5.7 m-85 -61.95 -30.29 70.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.069 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 75.02 18.94 80.16 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 51.2 mt -88.91 2.36 53.91 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.323 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.419 ' HA ' HD21 ' A' ' 85' ' ' LEU . 67.7 t0 -60.42 -41.03 93.13 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.409 -179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.69 163.5 32.71 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.45 ' HG2' ' H ' ' A' ' 95' ' ' ASP . 65.5 tttm -148.51 158.66 44.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.921 0.391 . . . . 0.0 110.476 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -79.62 7.88 7.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.53 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.45 ' H ' ' HG2' ' A' ' 93' ' ' LYS . 67.1 t0 -61.43 -41.43 97.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.748 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 63.8 112.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.863 0.363 . . . . 0.0 110.807 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -137.78 144.47 41.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.278 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -162.17 123.71 2.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.591 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.32 137.12 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.835 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 99.9 m -108.67 110.91 22.46 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.579 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.1 p -168.34 165.27 12.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.643 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 66.0 t30 54.34 85.85 0.05 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.713 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.0 t -112.85 124.72 53.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.451 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.0 mp -128.86 148.81 50.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.621 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.9 m -68.33 -77.94 0.07 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.678 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 55.19 91.58 0.01 OUTLIER Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.439 ' OG1' ' N ' ' A' ' 108' ' ' GLN . 29.7 p -88.51 -62.99 1.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.931 0.396 . . . . 0.0 110.706 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.439 ' N ' ' OG1' ' A' ' 107' ' ' THR . 58.3 tt0 -151.68 155.74 38.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.545 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.42 ' OE1' ' OD2' ' A' ' 113' ' ' ASP . 69.2 mm-40 -124.07 133.98 53.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.65 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.423 ' OD1' ' C ' ' A' ' 110' ' ' ASP . 53.8 p30 -160.76 -174.28 4.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.628 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -45.44 -64.85 2.13 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.486 HD23 ' N ' ' A' ' 112' ' ' LEU . 0.1 OUTLIER -122.6 87.9 2.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.857 0.36 . . . . 0.0 110.777 -179.776 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.42 ' OD2' ' OE1' ' A' ' 109' ' ' GLU . 33.0 p30 -94.64 -10.44 31.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.414 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -100.41 128.9 29.13 Favored Pre-proline 0 C--O 1.233 0.201 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.418 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -49.69 -35.47 38.49 Favored 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.41 2.073 . . . . 0.0 112.11 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -61.8 -45.13 95.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.871 0.367 . . . . 0.0 110.973 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.83 -38.52 89.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.542 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.538 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 97.7 mt-10 -61.67 -38.13 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.579 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.602 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 63.7 mttp -61.22 -45.74 93.31 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.54 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.529 HD13 ' HZ ' ' A' ' 142' ' ' PHE . 41.5 mt -64.13 -46.15 85.43 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.913 0.387 . . . . 0.0 111.888 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.648 ' CE2' HD13 ' A' ' 135' ' ' LEU . 18.0 t-105 -57.8 -49.38 76.82 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.755 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.538 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 7.7 m-70 -72.76 -31.99 65.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.46 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 119' ' ' LYS . 1.0 OUTLIER -54.82 -51.52 65.59 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.73 -179.109 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.71 -46.59 52.9 Favored 'General case' 0 C--O 1.247 0.924 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.69 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 49.7 tttm -50.34 -41.59 51.6 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.781 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.5 m -95.08 -38.14 10.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.95 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 5.8 t -45.45 -27.34 0.7 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.961 0.41 . . . . 0.0 109.952 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -156.79 -92.26 0.09 OUTLIER Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.339 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -162.79 25.1 0.1 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.361 0.6 . . . . 0.0 109.525 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.423 ' O ' ' HG ' ' A' ' 135' ' ' LEU . 8.7 m-85 -69.76 51.06 0.11 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.378 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 2.0 m -106.48 139.11 41.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.25 0.548 . . . . 0.0 111.747 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 89.12 -98.11 2.4 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.589 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 81.6 mm-40 -72.96 -43.83 61.83 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.96 -179.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -61.27 -49.35 77.42 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.304 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.648 HD13 ' CE2' ' A' ' 121' ' ' TRP . 1.5 mt -59.73 -40.4 87.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.306 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.56 -41.01 98.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.026 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.8 mttt -60.56 -42.75 97.24 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 121.387 0.613 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.71 -42.96 94.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.29 94.26 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.834 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -51.69 -41.64 61.6 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.65 -40.89 76.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.508 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.529 ' HZ ' HD13 ' A' ' 120' ' ' LEU . 10.7 m-85 -60.38 -52.43 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.429 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.9 mm? -60.36 -41.09 92.98 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.247 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -53.88 -46.69 71.41 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.51 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.833 ' O ' HG22 ' A' ' 149' ' ' VAL . 9.3 m-70 -61.37 -40.58 94.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -59.37 -43.67 92.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.343 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 143' ' ' LEU . 3.7 mp0 -70.7 -46.88 62.3 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.553 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.5 mttp -62.15 -47.05 86.26 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.12 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.833 HG22 ' O ' ' A' ' 145' ' ' HIS . 26.1 m -65.59 -37.13 79.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.02 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.724 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -63.81 -41.19 97.94 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.416 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -65.47 -45.65 82.87 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.332 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -62.86 -47.25 84.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 110.616 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . 0.404 ' O ' ' CG ' ' A' ' 157' ' ' GLU . 1.3 m120 -70.54 -46.61 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.226 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 150' ' ' HIS . 75.6 t -62.27 -46.06 97.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.702 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.74 -51.69 66.14 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.447 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.716 HD12 ' C ' ' A' ' 156' ' ' LEU . 0.4 OUTLIER -66.1 -38.19 87.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.217 0.532 . . . . 0.0 110.515 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.539 ' N ' ' HG ' ' A' ' 156' ' ' LEU . 93.2 mt-10 -69.28 -33.75 73.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.34 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 64.0 m -65.97 -46.01 79.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.963 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.718 HD12 ' N ' ' A' ' 160' ' ' SER . 4.1 pp -77.55 -24.51 49.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.868 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.718 ' N ' HD12 ' A' ' 159' ' ' LEU . 81.9 p -67.6 -39.81 84.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.854 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -65.22 -44.71 87.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.188 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.681 HG22 ' H ' ' A' ' 163' ' ' GLU . 1.6 m -96.18 176.52 6.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.636 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.681 ' H ' HG22 ' A' ' 162' ' ' THR . 70.9 mm-40 54.66 2.76 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.014 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.596 ' H ' ' C ' ' A' ' 162' ' ' THR . 65.1 tt0 -135.46 43.14 2.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.691 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.491 ' O ' ' CG ' ' A' ' 166' ' ' HIS . 16.6 tt -134.42 129.3 52.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.969 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.491 ' CG ' ' O ' ' A' ' 165' ' ' ILE . 73.9 m80 -159.36 24.45 0.19 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.745 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 167' ' ' GLU . 76.6 tt0 44.1 45.6 6.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.427 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -153.88 159.22 41.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.404 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 5.8 m -152.9 37.45 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.676 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.434 ' O ' HG23 ' A' ' 170' ' ' ILE . 19.4 tt -154.54 130.81 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.64 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.49 158.27 1.99 Allowed Pre-proline 0 C--N 1.328 -0.342 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.388 179.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -55.64 141.23 84.1 Favored 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.55 2.167 . . . . 0.0 112.011 179.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.547 ' OG ' ' N ' ' A' ' 178' ' ' ILE . 22.9 t -154.91 130.78 10.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.695 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -101.66 -17.56 16.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.632 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.706 ' O ' ' N ' ' A' ' 177' ' ' ASP . 6.5 tt -112.49 113.91 26.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.966 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . 0.405 ' HB2' HD23 ' A' ' 175' ' ' LEU . 10.6 m 46.22 -79.32 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.163 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.706 ' N ' ' O ' ' A' ' 175' ' ' LEU . 47.5 t0 -154.62 24.15 0.46 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.783 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.629 HD11 HD22 ' A' ' 175' ' ' LEU . 1.7 pp -139.47 166.42 21.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.856 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -65.05 134.64 54.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.222 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -62.58 130.92 43.73 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.515 ' OG ' ' N ' ' A' ' 182' ' ' VAL . 0.3 OUTLIER 175.47 -83.66 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.763 0.316 . . . . 0.0 110.58 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.616 ' C ' ' H ' ' A' ' 184' ' ' HIS . 97.0 t -140.59 -97.59 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.744 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.513 ' O ' ' HG2' ' A' ' 186' ' ' ARG . 9.7 tp 62.37 -37.69 0.14 Allowed 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.387 0.613 . . . . 0.0 110.848 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.616 ' H ' ' C ' ' A' ' 182' ' ' VAL . 13.8 p80 -56.93 -25.4 57.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.428 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.458 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 11.6 t -63.81 -46.02 87.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.514 -179.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.736 ' O ' HD13 ' A' ' 190' ' ' LEU . 21.0 ptt180 -71.07 -41.57 70.53 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.326 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . 0.624 ' CE1' ' HE ' ' A' ' 186' ' ' ARG . 52.4 m-70 -65.02 -39.54 93.53 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.22 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 56.7 m -63.56 -44.16 94.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.996 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.95 -43.41 98.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.021 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.736 HD13 ' O ' ' A' ' 186' ' ' ARG . 9.7 mp -63.26 -44.21 95.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 62.5 mttp -67.87 -40.0 83.64 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -68.66 -50.56 50.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.839 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.592 ' HZ2' ' HA ' ' A' ' 190' ' ' LEU . 2.6 pttm -67.09 -42.93 83.79 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.202 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.751 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -69.74 -37.84 76.62 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.47 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.508 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 11.6 mmm180 -63.4 -39.87 95.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 58.1 m -62.02 -42.59 99.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.77 -44.09 96.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.786 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -62.78 -40.98 99.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.522 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.58 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 95.2 mt-30 -62.03 -37.91 86.71 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.293 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.82 -41.48 98.82 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 201' ' ' LEU . 26.7 mt -63.82 -40.56 96.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.009 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.58 ' OD2' ' O ' ' A' ' 199' ' ' GLN . 0.1 OUTLIER -61.91 -38.17 87.39 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.413 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 203' ' ' ARG . 0.0 OUTLIER -63.45 -42.63 98.64 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.678 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.2 mt -60.56 -40.15 90.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.354 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -64.19 -43.08 96.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.062 179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.732 ' O ' ' N ' ' A' ' 210' ' ' GLN . 95.8 mtt-85 -63.14 -44.67 94.9 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.228 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 0.7 OUTLIER -64.39 -38.17 81.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.754 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 18.6 m -62.15 -35.7 79.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -103.89 -19.6 14.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.241 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.732 ' N ' ' O ' ' A' ' 206' ' ' ARG . 44.1 tt0 -115.84 -26.0 7.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -70.02 35.76 0.4 Allowed Glycine 0 CA--C 1.521 0.441 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.551 ' CG ' ' N ' ' A' ' 213' ' ' SER . 63.5 t80 -137.77 165.74 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.837 0.351 . . . . 0.0 110.652 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.551 ' N ' ' CG ' ' A' ' 212' ' ' TYR . 16.1 t -44.89 89.26 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.829 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . 0.732 HG22 ' H ' ' A' ' 215' ' ' GLU . 27.7 m -138.35 175.28 9.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.459 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.732 ' H ' HG22 ' A' ' 214' ' ' THR . 44.8 tt0 -145.93 166.16 26.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.499 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . 0.55 ' N ' ' HG2' ' A' ' 215' ' ' GLU . . . 65.15 143.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.684 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -167.15 -15.02 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.939 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.511 ' C ' ' H ' ' A' ' 220' ' ' GLU . 75.0 m-85 -135.03 -170.86 2.66 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.286 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 219' ' ' GLU . 81.1 tt0 58.36 0.14 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.645 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.511 ' H ' ' C ' ' A' ' 218' ' ' PHE . 3.7 mp0 -34.86 151.04 0.07 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.663 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -76.2 47.83 2.13 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.488 2.125 . . . . 0.0 112.223 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.502 ' HA ' ' HE ' ' A' ' 222' ' ' ARG . 0.0 OUTLIER -125.86 -82.57 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.798 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.454 HG13 ' H ' ' A' ' 224' ' ' ILE . 0.3 OUTLIER -59.61 -53.37 49.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.495 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 223' ' ' VAL . 0.7 OUTLIER -62.09 -34.96 66.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.356 0.598 . . . . 0.0 109.495 -179.467 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -65.91 -36.39 83.24 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.66 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.34 -43.06 92.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.61 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 43.4 m0 -62.42 -37.85 87.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.738 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -58.75 -40.61 84.37 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 231' ' ' GLN . 89.2 mt -62.96 -42.39 99.81 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.75 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.726 ' O ' HD11 ' A' ' 235' ' ' LEU . . . -38.96 -27.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 229' ' ' LEU . 17.4 tt0 -60.47 -42.44 96.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.634 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 229' ' ' LEU . 20.8 m -125.64 61.66 1.23 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.655 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -127.73 -70.79 0.69 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.551 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -173.31 89.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.846 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.726 HD11 ' O ' ' A' ' 230' ' ' ALA . 0.1 OUTLIER -136.01 -156.13 0.69 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.68 -179.679 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 168.49 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.499 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -59.69 -54.55 45.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.858 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.43 -41.77 93.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.172 0.511 . . . . 0.0 110.558 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -59.43 -34.27 72.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.201 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 240' ' ' LEU . 0.1 OUTLIER -62.11 -43.25 99.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.793 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -65.85 -50.6 63.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.535 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.72 89.33 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.132 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.47 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -65.02 -42.13 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.329 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -54.69 -52.93 60.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.983 0.42 . . . . 0.0 110.434 -179.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -65.61 -38.84 90.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.92 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -57.41 -54.14 50.24 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.364 0.602 . . . . 0.0 110.616 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 247' ' ' LEU . 4.6 mm? -63.05 -37.13 85.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.534 179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.558 ' O ' ' HG3' ' A' ' 251' ' ' GLU . 43.3 tttp -55.32 -43.0 74.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 110.223 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -70.18 -39.3 75.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.334 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -60.65 -49.29 78.1 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.29 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.597 ' OE1' ' N ' ' A' ' 252' ' ' ALA . 0.1 OUTLIER -62.09 -39.4 92.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . 0.597 ' N ' ' OE1' ' A' ' 251' ' ' GLU . . . -66.14 -37.32 85.41 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.536 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -62.74 -48.4 79.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.053 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -37.98 81.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.309 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -59.18 -47.13 86.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.511 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -63.21 -43.34 98.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.293 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . 0.404 ' ND1' ' N ' ' A' ' 258' ' ' ASN . 0.1 OUTLIER -58.2 -43.81 87.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.361 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . 0.421 ' OD1' ' C ' ' A' ' 258' ' ' ASN . 43.4 t-20 -61.14 -41.54 96.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.344 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -60.58 -48.56 81.24 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.1 0.476 . . . . 0.0 110.529 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -62.7 -34.56 77.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.397 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.544 HE21 ' CG2' ' A' ' 297' ' ' THR . 69.0 mm-40 -62.62 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.219 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.32 -47.72 83.0 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.087 0.47 . . . . 0.0 109.903 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.58 -37.19 86.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.936 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 61.7 tp -62.96 -42.36 99.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.198 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -61.82 -48.82 78.88 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.508 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.29 -42.77 96.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.012 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.91 83.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.153 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -62.85 -48.43 79.06 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.408 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -59.91 -46.12 90.36 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 110.473 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.36 -40.65 95.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.364 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.415 HD13 ' CB ' ' A' ' 286' ' ' SER . 33.8 tp -59.73 -43.35 94.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.086 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -59.82 -44.14 94.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.12 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -68.15 -40.7 82.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.727 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.578 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -62.11 -37.04 83.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.728 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . 0.666 ' OE2' HG13 ' A' ' 283' ' ' VAL . 62.1 mm-40 -55.11 -19.56 7.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.871 0.367 . . . . 0.0 110.619 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 71.1 m -76.58 -11.46 59.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.613 HG13 ' N ' ' A' ' 278' ' ' GLY . 7.9 p -63.06 -46.91 94.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.686 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.613 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 79.95 -13.3 25.86 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . 0.475 ' H ' HG13 ' A' ' 277' ' ' VAL . 81.3 m-20 -76.65 -11.6 59.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.782 0.325 . . . . 0.0 110.608 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 65.01 -140.35 41.83 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 60.72 -71.87 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.893 0.378 . . . . 0.0 110.598 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 280' ' ' GLY . 55.2 ttt85 -60.94 -33.51 73.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.416 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . 0.666 HG13 ' OE2' ' A' ' 275' ' ' GLU . 42.7 t -59.78 -45.65 94.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.548 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 45.6 t -61.16 -47.42 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.979 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.05 -47.3 80.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.922 0.391 . . . . 0.0 111.037 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . 0.415 ' CB ' HD13 ' A' ' 271' ' ' LEU . 44.4 m -59.93 -43.31 95.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.685 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -63.91 -40.63 96.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.893 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -58.79 -59.11 5.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.322 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.66 ' HD3' HD23 ' A' ' 292' ' ' LEU . 21.3 mmtm -63.96 -40.93 97.54 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.956 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -44.65 -53.96 6.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.16 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -67.4 -35.43 79.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.438 179.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.66 HD23 ' HD3' ' A' ' 289' ' ' LYS . 20.8 tp -60.39 -50.22 74.47 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.322 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.36 -42.08 98.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.303 0.573 . . . . 0.0 109.936 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.501 ' O ' ' OG1' ' A' ' 297' ' ' THR . 16.2 tm-20 -62.0 -39.71 93.16 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.955 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -62.91 -40.91 99.86 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 7.9 tpp180 -61.73 -43.73 98.28 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.323 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.544 ' CG2' HE21 ' A' ' 261' ' ' GLN . 44.0 p -60.42 -43.85 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.263 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -62.78 -43.92 97.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.461 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -61.5 -42.02 98.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.283 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -44.59 96.46 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.412 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.26 -44.89 93.21 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -62.15 -41.98 98.81 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.115 0.483 . . . . 0.0 110.462 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . 0.423 ' O ' ' ND1' ' A' ' 307' ' ' HIS . 19.3 m -60.52 -44.5 95.97 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.424 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 2.0 t -61.26 -42.35 93.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.896 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -56.98 -48.33 78.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.075 0.465 . . . . 0.0 110.313 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -63.34 -41.55 98.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.694 179.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.423 ' ND1' ' O ' ' A' ' 303' ' ' THR . 37.4 m80 -65.01 -36.47 84.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.239 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.61 HD23 ' CZ2' ' A' ' 227' ' ' TRP . 6.0 mt -62.38 -44.84 95.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.835 0.35 . . . . 0.0 110.34 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -69.86 -42.87 72.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.472 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -64.19 -45.23 89.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.791 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . 23.1 mt -62.31 -43.52 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.741 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 95.4 p -61.94 -38.49 88.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.357 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.57 -42.9 95.36 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.449 ' O ' HD21 ' A' ' 323' ' ' LEU . 66.8 mtp180 -66.1 -67.32 0.45 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.761 0.315 . . . . 0.0 110.879 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.585 ' O ' ' N ' ' A' ' 317' ' ' ARG . 4.8 mt -53.02 -94.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . 0.549 ' C ' ' O ' ' A' ' 315' ' ' ILE . 6.6 t 25.08 -88.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.914 0.388 . . . . 0.0 110.575 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 315' ' ' ILE . 55.4 ttp180 -62.75 -47.52 83.17 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.559 ' N ' ' O ' ' A' ' 315' ' ' ILE . . . 28.59 61.32 0.13 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.38 0.61 . . . . 0.0 109.713 -177.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.528 HH21 ' C ' ' A' ' 323' ' ' LEU . 20.4 ptt180 -42.11 -101.94 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.234 -0.893 . . . . 0.0 112.239 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . 0.482 ' H ' ' HG3' ' A' ' 319' ' ' ARG . 15.3 p80 -141.75 18.07 2.16 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.301 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.512 ' O ' ' N ' ' A' ' 323' ' ' LEU . 27.7 t-20 -151.79 169.3 22.56 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.371 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 322' ' ' GLU . 79.2 tt0 -67.21 44.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.133 0.492 . . . . 0.0 109.784 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.533 HD12 ' N ' ' A' ' 323' ' ' LEU . 8.9 mp . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 117.914 -1.041 . . . . 0.0 110.618 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.4 m -128.55 151.04 49.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.476 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -142.83 153.95 43.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.451 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -150.35 141.08 22.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.828 0.347 . . . . 0.0 110.391 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -133.18 146.84 51.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.149 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -82.61 162.93 21.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.474 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.737 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 1.7 tt0 -171.38 -41.51 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.185 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.737 ' HD2' ' H ' ' A' ' 7' ' ' GLN . 86.4 Cg_endo -87.97 -96.09 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 122.726 2.284 . . . . 0.0 112.467 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.8 tptm 53.87 69.91 1.98 Allowed Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.228 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -66.78 -24.42 47.08 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.681 2.254 . . . . 0.0 112.263 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.7 m 46.79 80.05 0.31 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.405 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.89 161.14 44.44 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.757 2.304 . . . . 0.0 112.115 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -64.29 148.7 49.66 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.236 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -144.99 167.66 22.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.6 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -104.04 160.71 14.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.495 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.7 p -68.6 163.52 23.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.543 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.48 82.17 0.04 OUTLIER Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -143.0 107.67 4.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.744 0.306 . . . . 0.0 110.284 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -69.63 -40.53 76.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.803 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -102.09 -178.82 3.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.726 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.488 HH12 HD22 ' A' ' 57' ' ' LEU . 90.0 mtm180 -93.75 6.01 49.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.364 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.519 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 10.0 tpt -144.88 130.07 18.58 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -60.95 -38.29 85.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.357 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.8 -47.97 81.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.569 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 25' ' ' LEU . 95.6 mt -61.5 -38.63 88.05 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.727 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.519 ' ND2' ' O ' ' A' ' 22' ' ' MET . 69.4 m-80 -64.18 -40.13 95.46 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.488 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -60.77 -49.58 76.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.74 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.469 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 3.6 mm? -61.92 -40.88 97.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.215 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 47.7 t-105 -61.84 -46.26 90.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.134 0.492 . . . . 0.0 110.423 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.471 ' HA ' HE21 ' A' ' 33' ' ' GLN . 95.4 mt-10 -57.59 -42.85 83.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.462 179.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -61.6 -42.78 99.36 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.99 -44.69 87.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.162 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.471 HE21 ' HA ' ' A' ' 30' ' ' GLU . 33.8 mt-30 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.172 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -60.2 -43.48 95.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.142 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.9 mt -65.01 -36.87 85.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.261 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.85 110.37 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.741 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.8 mt -127.33 155.81 75.87 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.806 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -40.94 154.42 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.535 2.157 . . . . 0.0 112.189 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.71 -47.14 26.88 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.548 2.165 . . . . 0.0 112.556 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.25 -45.08 97.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.412 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.539 ' O ' HD13 ' A' ' 45' ' ' LEU . 22.2 mmt85 -63.86 -40.59 96.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.53 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 tp -62.54 -43.71 98.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.529 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.98 89.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.412 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -67.9 -48.56 65.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 41' ' ' ARG . 8.1 mp -62.98 -45.46 92.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.646 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -63.8 -44.11 94.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.851 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.631 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.18 -48.73 80.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.071 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -57.43 -46.89 83.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.926 0.393 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.13 -40.84 86.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.917 0.389 . . . . 0.0 110.046 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.22 -39.91 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.088 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.631 HG12 ' O ' ' A' ' 47' ' ' ALA . 33.9 mm -62.3 -43.78 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.054 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -58.62 -45.32 89.45 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.542 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.34 -47.01 87.03 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-O 121.128 0.489 . . . . 0.0 110.262 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -64.16 -39.56 94.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.684 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.426 ' C ' ' OD1' ' A' ' 55' ' ' ASP . 60.4 t0 -60.56 -43.46 97.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.597 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -61.72 -43.88 97.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.033 0.444 . . . . 0.0 110.135 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.488 HD22 HH12 ' A' ' 21' ' ' ARG . 52.1 tp -60.5 -41.74 94.91 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.199 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.3 99.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.605 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.8 -42.41 93.36 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.342 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -61.08 -45.45 94.67 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -57.84 -44.02 86.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.179 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.9 mt -61.92 -42.11 98.72 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.139 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -56.26 -47.05 79.3 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.27 -0.572 . . . . 0.0 109.639 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.3 mt -64.55 -37.59 88.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.946 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -61.83 -20.63 63.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.834 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.8 32.82 5.24 Favored Glycine 0 C--N 1.335 0.513 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 179.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 94.3 mt -123.35 -164.42 1.21 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.257 0.551 . . . . 0.0 110.333 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 61.79 95.32 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.44 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -127.6 -32.54 2.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.835 0.35 . . . . 0.0 110.475 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -65.33 -39.21 92.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.653 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 85.22 -0.17 88.72 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -64.31 -35.13 79.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.701 0.286 . . . . 0.0 110.275 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.409 ' O ' HD13 ' A' ' 77' ' ' LEU . 65.7 mttm -58.04 -59.8 4.72 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.129 0.49 . . . . 0.0 110.162 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -55.57 -41.48 73.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.283 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.685 ' HB1' ' NH1' ' A' ' 79' ' ' ARG . . . -61.2 -38.67 87.37 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.352 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -62.49 -42.94 99.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 73' ' ' LYS . 10.2 mp -62.47 -43.08 99.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.49 -47.52 91.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.215 0.531 . . . . 0.0 110.134 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.685 ' NH1' ' HB1' ' A' ' 75' ' ' ALA . 77.3 mtt85 -61.21 -41.22 96.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.218 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.436 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.58 -49.26 78.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.082 0.468 . . . . 0.0 110.346 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.07 -38.54 88.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 79' ' ' ARG . 48.1 t -62.14 -47.05 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.636 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.8 -49.35 84.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.436 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.476 HD21 ' HA ' ' A' ' 91' ' ' ASP . 13.7 tp -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.035 0.445 . . . . 0.0 110.724 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.84 93.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.849 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -61.63 -48.38 81.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.435 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -76.25 -16.31 59.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.12 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 58.51 38.42 91.03 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 90' ' ' LEU . 39.5 mt -102.09 14.98 30.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 110.547 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.476 ' HA ' HD21 ' A' ' 85' ' ' LEU . 47.2 t0 -57.05 -48.02 79.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.594 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.55 154.17 22.81 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 14.8 mmmt -140.56 -85.56 0.2 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.763 0.316 . . . . 0.0 110.715 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -161.6 137.2 7.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.584 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.86 156.52 41.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.875 0.369 . . . . 0.0 110.7 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -155.55 106.59 2.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.346 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 51.3 ptt85 -140.69 142.25 34.9 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.802 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.517 ' N ' ' CD ' ' A' ' 98' ' ' GLN . 2.1 pm0 -137.96 73.08 1.43 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.397 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 55.4 t -122.37 131.27 73.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.33 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.1 p -110.7 7.12 22.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.558 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 90.9 p -61.26 -35.69 77.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.345 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.583 ' O ' ' N ' ' A' ' 104' ' ' LEU . 50.6 p-10 -85.13 -26.56 26.8 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.521 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.521 ' N ' ' OD1' ' A' ' 102' ' ' ASN . 10.5 m 47.66 -84.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.819 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.583 ' N ' ' O ' ' A' ' 102' ' ' ASN . 0.6 OUTLIER 45.07 56.18 5.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.147 0.499 . . . . 0.0 110.266 -179.844 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.1 p -149.37 164.72 34.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.555 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.54 78.18 1.29 Allowed Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 42.6 p -63.07 -34.12 76.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.635 0.255 . . . . 0.0 110.524 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -60.21 125.17 22.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.164 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -126.37 135.75 51.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.763 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 39.4 p-10 -149.99 123.02 8.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.395 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -147.97 -111.45 0.63 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.51 ' O ' ' CG ' ' A' ' 118' ' ' GLU . 5.5 mp -111.03 138.74 47.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.84 0.353 . . . . 0.0 110.748 -179.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.55 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 97.0 m-20 -88.31 -26.78 22.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.623 179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -61.63 109.07 1.87 Allowed Pre-proline 0 C--N 1.331 -0.216 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' A' ' 113' ' ' ASP . 52.5 Cg_exo -52.6 -37.8 74.83 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 122.514 2.143 . . . . 0.0 112.526 -179.132 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 83.1 mtt85 -63.15 -45.32 92.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.11 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.19 -32.83 56.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.733 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.627 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 39.6 mt-10 -58.44 -42.2 86.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 98.8 mttt -60.16 -42.55 95.16 Favored 'General case' 0 C--N 1.318 -0.761 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.435 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.4 mt -64.4 -47.44 79.18 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.068 0.461 . . . . 0.0 111.773 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.635 ' CZ2' HD13 ' A' ' 135' ' ' LEU . 10.2 t-105 -64.24 -44.78 90.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.592 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.627 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.8 m-70 -69.24 -34.98 75.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.745 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.554 ' O ' ' CB ' ' A' ' 127' ' ' SER . 8.4 mptt -60.25 -51.2 70.58 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.232 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -74.57 -46.31 39.63 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.722 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.45 ' HB2' HD11 ' A' ' 135' ' ' LEU . 62.9 tttp -53.21 -44.26 67.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.311 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 16.0 m -102.68 -60.08 1.6 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.935 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -61.65 -6.21 2.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.787 -178.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 130' ' ' PHE . . . -135.65 4.41 4.0 Favored Glycine 0 C--N 1.329 0.174 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.486 ' CG ' ' O ' ' A' ' 128' ' ' GLY . 19.0 ptpt 43.44 21.09 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.17 0.509 . . . . 0.0 109.84 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.495 ' N ' ' O ' ' A' ' 128' ' ' GLY . 32.8 m-85 -78.78 50.75 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.586 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.7 p -94.5 130.11 41.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 112.105 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 107.13 -98.72 1.33 Allowed Glycine 0 CA--C 1.534 1.267 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.869 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.446 ' HG2' ' H ' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -80.3 -43.64 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.049 -179.226 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 133' ' ' GLU . 67.8 mm-40 -64.96 -42.96 94.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.635 HD13 ' CZ2' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.79 -43.51 98.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.942 179.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -62.3 -39.29 92.51 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.952 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -60.41 -43.29 96.87 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.37 0.605 . . . . 0.0 109.852 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 134' ' ' GLU . 2.8 mm? -59.68 -43.84 93.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -36.92 85.65 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.55 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 88.7 mtt-85 -53.49 -41.51 66.33 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.542 ' N ' ' OE1' ' A' ' 141' ' ' GLU . 0.4 OUTLIER -71.26 -43.36 67.36 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.853 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -58.47 -54.86 42.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.407 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.49 -38.91 89.04 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.309 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 34.9 m170 -54.75 -42.79 72.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.613 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -66.31 -39.8 89.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.637 178.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -61.27 -47.25 86.87 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.379 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 148' ' ' LYS . 12.8 pt-20 -71.49 -43.01 67.33 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.541 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.417 ' N ' ' HG3' ' A' ' 147' ' ' GLU . 96.9 mttt -62.67 -44.13 97.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.797 0.332 . . . . 0.0 110.456 -179.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 24.9 t -64.4 -44.43 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.603 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.776 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.1 m170 -60.63 -39.58 88.75 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.43 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -62.81 -43.18 99.48 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.678 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.584 ' CE1' ' HE3' ' A' ' 193' ' ' LYS . 24.5 m-85 -65.45 -49.63 68.43 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.842 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -68.62 -42.26 78.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.023 0.44 . . . . 0.0 110.997 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 150' ' ' HIS . 73.2 t -63.03 -45.16 99.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.947 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.5 mt -63.58 -45.7 89.22 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.761 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -64.0 -42.19 97.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.564 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -69.68 -31.09 68.94 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.167 178.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . 0.517 ' HA ' HH21 ' A' ' 161' ' ' ARG . 64.0 m -64.34 -51.55 62.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.174 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 160' ' ' SER . 1.8 pp -72.01 -34.4 68.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.807 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.514 ' N ' HD12 ' A' ' 159' ' ' LEU . 74.5 m -60.51 -43.18 97.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.788 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.517 HH21 ' HA ' ' A' ' 158' ' ' THR . 88.6 mtm180 -63.39 -47.54 81.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.314 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.708 ' C ' ' H ' ' A' ' 164' ' ' GLU . 13.0 p -91.34 175.01 7.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.557 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 61.43 -18.78 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.045 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.708 ' H ' ' C ' ' A' ' 162' ' ' THR . 32.5 tt0 -109.3 42.22 1.49 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 15.4 tt -135.07 141.14 43.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.085 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.425 ' O ' ' CG ' ' A' ' 167' ' ' GLU . 0.3 OUTLIER -172.13 25.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.791 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 166' ' ' HIS . 18.4 pt-20 43.76 25.45 0.09 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.975 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -171.36 121.9 0.53 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.591 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 43.4 t -130.19 94.01 2.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.489 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.516 ' O ' HG23 ' A' ' 170' ' ' ILE . 19.8 tt -171.0 125.23 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.56 160.92 5.0 Favored Pre-proline 0 N--CA 1.453 -0.312 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.13 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -50.68 128.28 23.51 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 122.312 2.008 . . . . 0.0 111.788 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 51.0 p -154.78 161.23 41.58 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.495 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -160.12 -28.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.426 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 36.0 tp -84.89 102.13 12.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.934 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 6.4 m 43.99 26.05 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.469 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 60.27 27.52 17.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.632 ' O ' HD12 ' A' ' 178' ' ' ILE . 2.5 pp -141.89 165.47 17.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.531 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -72.3 139.13 47.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.411 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . -103.89 131.25 10.56 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.472 ' O ' ' NE2' ' A' ' 184' ' ' HIS . 1.9 m 174.9 -74.2 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.804 0.335 . . . . 0.0 110.504 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.67 HG12 ' O ' ' A' ' 182' ' ' VAL . 64.8 t -128.14 7.56 3.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.069 0.462 . . . . 0.0 110.573 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.84 -40.87 94.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.464 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.514 ' H ' ' CD2' ' A' ' 184' ' ' HIS . 6.9 p80 -53.7 -43.74 69.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.578 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 41.7 t -60.26 -44.06 95.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.196 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.549 ' O ' HD13 ' A' ' 190' ' ' LEU . 99.3 mtt180 -60.77 -45.57 93.81 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.098 -179.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -61.25 -39.91 92.09 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.291 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.9 m -61.11 -44.41 97.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.246 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -58.81 -40.34 83.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.971 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.549 HD13 ' O ' ' A' ' 186' ' ' ARG . 8.5 mp -63.18 -41.06 99.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.459 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.546 ' O ' ' CG ' ' A' ' 195' ' ' ARG . 67.5 mttm -67.35 -34.06 76.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.59 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 195' ' ' ARG . 97.2 mt-10 -67.6 -50.28 58.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.584 ' HE3' ' CE1' ' A' ' 152' ' ' TYR . 10.6 ptmt -72.28 -44.7 62.39 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.358 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.769 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -66.95 -41.51 86.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.102 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.546 ' CG ' ' O ' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -65.92 -36.88 84.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 55.6 m -61.56 -43.38 98.97 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.42 -44.12 97.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.849 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.439 ' ND2' ' CD1' ' A' ' 194' ' ' LEU . 94.3 m-20 -62.0 -42.05 98.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.582 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.477 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 14.9 mm100 -62.24 -38.59 89.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.381 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.4 -42.3 99.74 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 201' ' ' LEU . 18.3 mt -63.25 -41.97 99.12 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.235 179.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.498 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.1 OUTLIER -62.8 -36.64 83.8 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -63.92 -42.27 97.43 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.616 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.48 -39.43 90.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.409 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -62.04 -45.12 94.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.222 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.554 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.7 mtt180 -65.3 -36.58 84.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.16 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.693 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.3 t -63.51 -45.88 96.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.252 0.548 . . . . 0.0 110.279 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 80.6 p -72.37 -26.67 61.98 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.535 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -95.34 -14.58 23.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.513 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 206' ' ' ARG . 57.3 tt0 -146.11 -25.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.718 0.294 . . . . 0.0 111.109 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.693 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -73.06 33.7 0.76 Allowed Glycine 0 CA--C 1.518 0.271 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.52 ' H ' ' C ' ' A' ' 210' ' ' GLN . 68.9 t80 -60.76 -47.47 86.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.786 0.327 . . . . 0.0 110.37 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 174.79 85.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.407 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 33.5 p -134.39 165.15 25.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.501 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -140.42 140.65 35.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.715 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -74.63 143.23 44.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.507 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.442 ' O ' ' C ' ' A' ' 218' ' ' PHE . 11.8 mt-10 -158.64 34.04 0.23 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.247 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.569 ' O ' ' C ' ' A' ' 219' ' ' GLU . 33.7 m-85 -33.81 97.27 0.01 OUTLIER 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.426 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.569 ' C ' ' O ' ' A' ' 218' ' ' PHE . 2.2 tm-20 36.19 -139.38 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -178.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 59.3 mt-10 -87.26 148.97 46.05 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.163 176.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.75 81.93 1.27 Allowed 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.564 2.176 . . . . 0.0 112.146 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 175.98 -36.6 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.752 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.916 HG13 ' H ' ' A' ' 224' ' ' ILE . 1.5 p -68.92 -76.25 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.168 0.508 . . . . 0.0 110.698 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.916 ' H ' HG13 ' A' ' 223' ' ' VAL . 1.2 mp -50.61 -26.65 4.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.132 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -67.01 -50.03 63.43 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.371 0.605 . . . . 0.0 109.943 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 12.3 tp -56.79 -37.41 71.1 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 108.887 -0.782 . . . . 0.0 108.887 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . . . . . . . . . 44.8 m0 -63.96 -42.56 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.193 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . 0.507 ' O ' ' CG ' ' A' ' 231' ' ' GLN . 97.1 m-20 -66.76 -18.44 65.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 1.7 mt -77.81 -44.61 26.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.061 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 232' ' ' SER . . . -36.68 -62.16 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.198 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.507 ' CG ' ' O ' ' A' ' 228' ' ' ASP . 7.4 pt20 -38.39 -31.94 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.673 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.413 ' N ' ' O ' ' A' ' 230' ' ' ALA . 66.5 m -118.4 52.62 1.01 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.374 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -141.41 46.26 1.71 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . 0.542 ' ND2' ' N ' ' A' ' 234' ' ' ASN . 0.8 OUTLIER 61.95 72.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.379 179.574 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 235' ' ' LEU . 20.0 mt -125.08 148.04 48.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.696 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 66.6 p -66.36 -165.78 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.463 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . 0.548 ' OD1' ' N ' ' A' ' 238' ' ' LYS . 31.3 p-10 -95.84 -48.18 5.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . 0.548 ' N ' ' OD1' ' A' ' 237' ' ' ASP . 97.9 mttt -62.58 -43.35 99.03 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.03 0.443 . . . . 0.0 110.675 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -64.68 -33.63 76.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.013 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.67 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.2 OUTLIER -62.56 -43.49 98.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.306 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -65.12 -49.66 69.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.405 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -61.14 -39.91 91.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.089 0.471 . . . . 0.0 110.002 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.486 ' CD1' ' C ' ' A' ' 243' ' ' PHE . 0.6 OUTLIER -64.14 -44.11 93.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.103 179.033 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 244' ' ' ARG . 0.0 OUTLIER -60.03 -47.55 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.036 0.445 . . . . 0.0 110.193 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -65.62 -47.43 75.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.751 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -56.28 -50.94 69.93 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.495 0.664 . . . . 0.0 110.441 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 251' ' ' GLU . 3.6 mm? -63.43 -37.82 88.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.776 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.452 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 89.0 tttt -53.76 -45.38 70.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.391 0.615 . . . . 0.0 109.995 -179.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -67.48 -40.63 85.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.697 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -61.01 -48.98 79.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.638 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.452 ' CG ' ' O ' ' A' ' 248' ' ' LYS . 13.5 pt-20 -59.31 -38.16 79.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . 0.422 ' N ' ' HG3' ' A' ' 251' ' ' GLU . . . -65.48 -38.17 88.98 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.521 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -62.9 -49.57 74.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.554 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 9.7 tt -64.97 -31.84 55.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.17 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -62.22 -46.36 89.22 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.214 0.53 . . . . 0.0 110.054 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.22 -42.48 99.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.973 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -56.42 -43.83 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.339 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -61.93 -40.79 96.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.118 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -57.03 -46.33 82.45 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.274 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -63.7 -37.4 87.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.513 ' NE2' ' CG2' ' A' ' 297' ' ' THR . 30.8 mm-40 -57.72 -48.72 78.79 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.35 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -62.28 -43.1 99.61 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.189 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -65.49 -35.42 80.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.973 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 39.4 tp -63.7 -43.85 95.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.42 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -64.21 -44.72 91.06 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.542 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.44 -42.93 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.089 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -61.21 -38.61 87.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.361 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -62.02 -48.52 79.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -61.61 -46.69 88.78 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 110.66 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.78 -37.66 85.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.349 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 49.3 tp -61.82 -43.99 97.74 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -61.59 -43.0 99.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.41 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -72.13 -37.69 69.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.61 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -63.1 -37.12 85.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.862 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -64.7 -30.77 71.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.715 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 90.7 p -86.71 2.43 48.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.712 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 274' ' ' ALA . 9.5 p -60.74 -41.97 90.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.455 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.514 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 123.73 -57.45 0.65 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -96.74 111.35 23.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.803 0.335 . . . . 0.0 110.584 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -74.08 106.93 2.13 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -136.6 -21.08 1.32 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.311 . . . . 0.0 110.651 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -124.81 -4.22 7.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.705 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . 0.57 HG13 ' N ' ' A' ' 284' ' ' SER . 11.3 p -63.24 -46.04 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.817 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . 0.57 ' N ' HG13 ' A' ' 283' ' ' VAL . 10.6 t -63.78 -49.34 73.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.075 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.53 -43.03 98.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.86 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 48.5 t -60.27 -44.56 95.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.52 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 290' ' ' HIS . 60.0 ttt85 -63.24 -41.05 99.04 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.228 0.537 . . . . 0.0 110.632 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -56.81 -57.51 12.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.252 0.548 . . . . 0.0 109.959 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.564 ' HD3' HD23 ' A' ' 292' ' ' LEU . 46.8 mmtt -64.54 -31.34 72.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.153 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 287' ' ' ARG . 52.0 t-80 -53.13 -49.93 65.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -71.29 -37.62 71.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.618 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.564 HD23 ' HD3' ' A' ' 289' ' ' LYS . 26.3 tp -61.46 -50.76 71.46 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.594 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.3 mp -63.82 -41.65 97.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.135 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.16 -40.46 97.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.323 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.69 -47.21 91.8 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -63.66 -37.45 87.39 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.51 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.513 ' CG2' ' NE2' ' A' ' 261' ' ' GLN . 8.3 m -60.23 -50.27 74.31 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.488 -179.202 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -63.41 -40.07 96.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.412 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -58.93 -45.47 90.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.358 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.46 -44.51 96.98 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.297 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -55.36 -43.56 84.74 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . 0.475 ' CE1' ' NZ ' ' A' ' 306' ' ' LYS . 49.3 t80 -62.25 -42.43 99.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.162 0.506 . . . . 0.0 110.489 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . 0.454 HG22 ' ND1' ' A' ' 307' ' ' HIS . 17.2 m -60.48 -44.29 96.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.643 -179.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.31 -43.25 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.046 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.79 -49.44 76.61 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.045 0.45 . . . . 0.0 110.937 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . 0.475 ' NZ ' ' CE1' ' A' ' 302' ' ' TYR . 34.7 mmtm -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.805 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.454 ' ND1' HG22 ' A' ' 303' ' ' THR . 20.6 m80 -66.31 -31.25 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.921 179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.65 HD21 ' CG2' ' A' ' 223' ' ' VAL . 0.5 OUTLIER -61.12 -49.92 75.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.238 -179.706 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -69.71 -40.1 76.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.634 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -60.05 -51.17 70.76 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.885 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 311' ' ' LEU . 30.2 mt -63.25 -39.82 95.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.442 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 7.7 t -58.89 -43.41 90.94 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.685 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -65.9 -49.89 56.1 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.741 ' N ' ' HE ' ' A' ' 314' ' ' ARG . 0.0 OUTLIER -63.93 -43.6 95.4 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 3.7 mm -64.34 -43.14 97.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.809 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 99.5 p -56.07 -34.55 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.864 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 14.3 tpp180 -69.67 -75.53 0.11 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.493 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . 47.97 84.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.1 -178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -78.14 -164.01 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.15 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 45.4 m170 -42.42 -67.76 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.244 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.467 ' OD1' ' O ' ' A' ' 321' ' ' ASN . 36.6 p-10 -136.97 118.31 14.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.782 0.325 . . . . 0.0 110.514 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 321' ' ' ASN . 84.9 tt0 56.83 152.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.493 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.491 HD22 ' N ' ' A' ' 323' ' ' LEU . 4.2 mm? . . . . . 0 C--O 1.221 -0.42 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.235 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.5 p -140.31 132.4 27.93 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.474 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.631 HH12 ' CE ' ' A' ' 5' ' ' LYS . 70.6 ttt-85 -85.66 -34.6 21.29 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.508 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.472 ' HG2' ' N ' ' A' ' 5' ' ' LYS . 69.8 tt0 78.02 -121.21 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.851 179.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.631 ' CE ' HH12 ' A' ' 3' ' ' ARG . 7.6 ttpt 49.36 30.69 3.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.644 -179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.471 ' O ' ' O ' ' A' ' 5' ' ' LYS . 17.8 m120 39.95 -165.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -165.41 145.64 5.73 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.154 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.13 157.7 58.83 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.404 2.069 . . . . 0.0 112.321 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.673 ' H ' ' HD2' ' A' ' 10' ' ' PRO . 4.7 mtpm? -137.54 -60.89 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.335 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.134 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.673 ' HD2' ' H ' ' A' ' 9' ' ' LYS . 83.4 Cg_exo -36.35 143.64 0.11 Allowed 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.571 2.18 . . . . 0.0 112.424 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.15 172.58 7.06 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.813 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -62.51 145.85 95.48 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.976 2.45 . . . . 0.0 112.171 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -131.05 144.6 51.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.52 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 80.8 mtp85 -135.41 144.72 46.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.314 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 58.29 111.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.441 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.9 m -121.92 122.07 38.54 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.621 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -94.43 157.58 22.55 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -173.03 110.13 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.48 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' N ' ' OE1' ' A' ' 19' ' ' GLU . 56.3 mp0 -93.88 -24.36 17.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.901 0.381 . . . . 0.0 110.556 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -133.91 162.06 33.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.728 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp85 -77.4 -11.48 59.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.69 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -134.83 145.7 48.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 110.988 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.35 -33.65 76.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.722 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.4 ' O ' HD23 ' A' ' 28' ' ' LEU . 58.1 mttm -59.02 -47.23 85.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 109.887 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.467 ' N ' HD12 ' A' ' 25' ' ' LEU . 9.4 mp -64.13 -37.94 89.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.292 178.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -63.79 -41.24 97.96 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.602 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -65.15 -45.12 86.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.107 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.409 ' N ' ' CD2' ' A' ' 28' ' ' LEU . 1.6 mm? -63.36 -41.78 98.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.479 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -63.29 -47.81 80.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.09 0.472 . . . . 0.0 110.358 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.5 ' OE2' ' NH2' ' A' ' 34' ' ' ARG . 80.8 tt0 -60.83 -39.19 88.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.199 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -45.0 96.38 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.06 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -41.36 96.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -59.45 -40.05 85.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.027 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.5 ' NH2' ' OE2' ' A' ' 30' ' ' GLU . 99.6 mtt180 -64.57 -39.01 92.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.339 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.4 mt -63.54 -36.73 84.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.383 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 65.95 106.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.604 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -129.4 154.47 80.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.63 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 74.3 Cg_exo -43.95 153.77 0.28 Allowed 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.369 2.046 . . . . 0.0 112.528 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 38' ' ' PRO . 38.4 Cg_exo -58.73 -41.05 67.31 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.681 2.254 . . . . 0.0 112.364 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.01 -49.12 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.852 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.74 -41.57 92.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.622 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -65.25 -42.36 93.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -51.71 64.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.176 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.01 -38.48 86.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.504 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.9 tp -62.16 -50.77 70.51 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.043 0.449 . . . . 0.0 110.621 -179.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -61.1 -40.82 95.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.21 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.615 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.29 -49.77 75.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.073 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -58.82 -46.03 88.58 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.996 0.427 . . . . 0.0 110.584 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.0 mt -59.93 -41.07 90.95 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -58.99 -38.79 80.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.145 178.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 47' ' ' ALA . 45.5 mm -62.16 -44.42 99.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -58.81 -43.96 90.69 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.606 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.97 -48.37 81.79 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.971 0.415 . . . . 0.0 110.453 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -60.25 -44.54 95.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.752 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.94 -40.66 94.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.505 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.07 -45.74 91.9 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 110.103 179.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.31 -42.97 99.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.966 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.83 96.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.557 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 78.2 t90 -58.52 -44.08 89.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.095 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.77 -46.5 90.21 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 120.624 -0.43 . . . . 0.0 109.914 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -62.11 -41.05 97.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.085 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.449 HD13 ' HZ2' ' A' ' 73' ' ' LYS . 79.7 mt -61.62 -41.2 97.14 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.45 -38.74 88.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.667 ' O ' HD23 ' A' ' 64' ' ' LEU . 3.1 tt -60.88 -43.69 98.11 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.87 -35.03 79.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.43 179.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 99.48 36.96 4.16 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 111.263 -0.735 . . . . 0.0 111.263 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 88.7 mt -96.55 -69.19 0.77 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.75 0.309 . . . . 0.0 110.649 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.469 ' OD1' ' O ' ' A' ' 68' ' ' ASP . 16.2 p30 -63.26 142.52 58.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.472 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -160.36 -26.42 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.528 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -68.16 -27.44 66.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.461 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.9 8.91 83.54 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.02 -40.69 91.29 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.573 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.449 ' HZ2' HD13 ' A' ' 62' ' ' LEU . 39.7 mtpt -62.49 -47.81 82.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.021 0.439 . . . . 0.0 110.362 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.99 -42.55 94.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.467 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.84 -40.28 94.77 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -62.25 -41.97 98.92 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.316 -0.554 . . . . 0.0 109.608 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.52 -43.8 96.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.444 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.77 -45.66 94.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.302 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.776 ' O ' HG23 ' A' ' 83' ' ' VAL . 92.1 mtt-85 -63.09 -41.29 99.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.992 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.405 ' HA ' HD22 ' A' ' 80' ' ' ASN . 10.4 m120 -64.03 -39.59 94.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.337 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.587 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -60.16 -51.39 69.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.901 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.436 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 60.7 t-20 -66.23 -38.91 89.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.705 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 79' ' ' ARG . 60.8 t -62.29 -47.46 92.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.691 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.9 -47.11 94.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.63 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 85' ' ' LEU . 11.6 tp -66.23 -41.11 90.51 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.638 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.59 -47.62 84.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.989 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -62.64 -44.8 95.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 110.404 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -63.65 -32.74 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.065 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 79.46 22.61 64.43 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.8 mt -98.11 14.92 25.88 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.886 0.374 . . . . 0.0 110.338 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -60.89 -43.78 98.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.693 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 150.89 -116.72 0.79 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.8 tttt 60.93 124.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.006 0.432 . . . . 0.0 110.301 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -104.62 133.14 49.97 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.935 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -93.21 -35.48 13.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.743 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 56.99 78.83 0.21 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.888 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -128.6 -72.85 0.6 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.364 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 63.0 tp60 57.95 103.04 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.788 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.4 ' O ' HG13 ' A' ' 99' ' ' VAL . 8.1 p -126.44 131.89 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.536 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -87.27 -25.84 23.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.747 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.2 t -69.2 152.73 44.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.613 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -126.39 168.9 13.54 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.606 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 69.4 p 45.29 50.4 9.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.479 HD22 ' N ' ' A' ' 104' ' ' LEU . 4.4 mm? -62.22 -43.19 99.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.506 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.1 m -160.87 -46.45 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.563 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.48 95.57 1.71 Allowed Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.6 m -61.1 -44.45 97.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.756 0.312 . . . . 0.0 110.814 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 55.39 78.46 0.19 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.743 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -72.09 -38.96 69.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.86 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -85.35 167.16 15.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.811 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -137.3 -78.36 0.08 OUTLIER Glycine 0 CA--C 1.523 0.579 0 N-CA-C 111.096 -0.801 . . . . 0.0 111.096 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.4 mt -112.36 141.74 45.72 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -119.73 -84.64 0.66 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.699 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -58.13 144.13 77.04 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.656 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.1 -20.91 43.44 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.419 2.079 . . . . 0.0 112.16 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -65.23 -38.97 92.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.934 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 5.1 mp -85.78 -27.19 25.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.863 0.364 . . . . 0.0 110.778 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 93.5 mt-10 -59.5 -44.02 93.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 20.3 pttp -60.6 -41.5 94.89 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.257 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.429 ' N ' ' CG ' ' A' ' 119' ' ' LYS . 11.8 mt -62.12 -44.92 95.59 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.638 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.578 ' CZ3' HD22 ' A' ' 135' ' ' LEU . 15.6 t-105 -61.76 -47.16 86.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.318 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.508 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 10.9 m-70 -67.68 -38.9 84.34 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.125 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.545 ' O ' ' CB ' ' A' ' 127' ' ' SER . 12.9 tptt -58.58 -51.45 69.83 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.911 -178.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.04 -45.75 63.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.649 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.407 ' HD2' ' HE1' ' A' ' 121' ' ' TRP . 65.0 tttm -48.33 -44.45 34.19 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 128' ' ' GLY . 23.3 m -107.08 -60.54 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.818 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -54.71 -8.87 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.898 -178.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.556 ' C ' ' H ' ' A' ' 130' ' ' PHE . . . -137.58 4.38 3.34 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 48.92 11.03 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.135 0.493 . . . . 0.0 109.786 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.556 ' H ' ' C ' ' A' ' 128' ' ' GLY . 24.3 m-85 -71.58 50.45 0.18 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.421 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.47 ' HA ' HD12 ' A' ' 135' ' ' LEU . 4.7 p -97.94 112.9 24.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 112.145 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.44 -98.37 0.62 Allowed Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.711 177.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.465 ' CG ' ' N ' ' A' ' 134' ' ' GLU . 10.0 pt-20 -77.18 -44.0 31.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.839 0.352 . . . . 0.0 111.31 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.465 ' N ' ' CG ' ' A' ' 133' ' ' GLU . 79.5 mm-40 -66.08 -41.92 90.05 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.578 HD22 ' CZ3' ' A' ' 121' ' ' TRP . 0.5 OUTLIER -61.07 -43.18 99.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.862 179.373 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.513 ' C ' ' OD1' ' A' ' 136' ' ' ASP . 0.3 OUTLIER -62.31 -37.99 87.68 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.936 179.769 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.434 ' N ' ' OD1' ' A' ' 136' ' ' ASP . 36.2 mmtm -60.15 -44.15 95.2 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.981 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 134' ' ' GLU . 3.6 mm? -60.64 -43.03 98.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.34 -34.84 79.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 177.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -58.5 -39.09 79.09 Favored 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.988 178.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.489 ' OE1' HD21 ' A' ' 204' ' ' LEU . 97.4 mt-10 -70.62 -44.29 67.51 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.995 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -58.91 -56.29 24.18 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.74 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.785 ' O ' ' HG2' ' A' ' 146' ' ' LYS . 97.4 mt -60.82 -39.84 90.53 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.579 -0.448 . . . . 0.0 109.815 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -55.19 -41.28 71.75 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.479 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -63.87 -45.88 87.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.384 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.785 ' HG2' ' O ' ' A' ' 143' ' ' LEU . 46.7 pttt -57.55 -45.75 84.74 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.549 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.533 ' N ' ' CG ' ' A' ' 146' ' ' LYS . 77.8 mm-40 -68.91 -50.18 51.7 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -63.09 -44.32 96.04 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.975 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 1.2 p -64.88 -38.09 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.716 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 154' ' ' VAL . 2.3 m170 -65.92 -41.26 91.63 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.228 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.38 -43.16 95.37 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.939 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.52 ' CE1' ' HD2' ' A' ' 193' ' ' LYS . 3.8 m-85 -61.88 -50.84 70.62 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.853 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -69.77 -44.05 70.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.307 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 150' ' ' HIS . 74.2 t -63.4 -46.9 94.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.922 -179.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 74.0 mt -63.91 -48.48 76.44 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.401 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.698 HD12 ' C ' ' A' ' 156' ' ' LEU . 0.3 OUTLIER -65.87 -39.72 90.97 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.014 -179.88 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.53 ' O ' ' OG ' ' A' ' 160' ' ' SER . 93.9 mt-10 -68.18 -30.69 69.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.321 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 61.2 m -66.16 -47.51 73.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.338 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.437 HD12 ' N ' ' A' ' 160' ' ' SER . 3.4 pp -77.56 -21.21 52.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.567 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 157' ' ' GLU . 95.2 p -61.88 -24.58 67.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.728 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 -59.97 -45.58 92.23 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.038 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.44 24.46 3.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.018 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -114.25 -26.63 7.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.396 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -85.72 33.3 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.954 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.503 HG23 ' O ' ' A' ' 165' ' ' ILE . 16.6 tt -134.24 128.46 52.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.03 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 51.6 m80 -157.68 25.67 0.28 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.343 0.592 . . . . 0.0 109.553 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.537 ' O ' ' CG ' ' A' ' 168' ' ' ASN . 77.8 tt0 55.95 46.92 21.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.396 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.537 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 2.8 p-10 47.35 55.5 8.15 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.394 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 51.5 t -124.99 131.57 72.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.96 0.409 . . . . 0.0 110.584 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 19.0 tt -142.29 142.35 27.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.627 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . 0.471 ' O ' ' N ' ' A' ' 173' ' ' SER . 0.3 OUTLIER -132.4 155.49 81.2 Favored Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.214 179.775 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -63.42 64.5 0.18 Allowed 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.586 2.191 . . . . 0.0 111.911 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.471 ' N ' ' O ' ' A' ' 171' ' ' SER . 3.9 m -158.45 121.97 3.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.925 0.393 . . . . 0.0 110.735 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -66.65 -40.53 88.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.428 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.583 ' O ' ' N ' ' A' ' 177' ' ' ASP . 93.0 mt -120.95 88.13 2.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.274 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 48.4 -84.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.276 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 175' ' ' LEU . 55.5 p30 -171.36 30.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.696 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.662 ' O ' HD12 ' A' ' 178' ' ' ILE . 1.6 pp -126.69 163.21 29.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.908 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -87.63 50.4 1.99 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.409 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 79.23 18.61 73.91 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 7.3 t -67.72 -22.22 65.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.788 0.327 . . . . 0.0 110.927 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.503 HG12 ' N ' ' A' ' 183' ' ' LEU . 9.0 t -133.67 165.55 31.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.645 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.734 ' CD1' HH21 ' A' ' 186' ' ' ARG . 0.9 OUTLIER 62.23 4.76 1.32 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.421 -179.87 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.654 ' ND1' ' N ' ' A' ' 185' ' ' SER . 5.7 p80 -65.64 -36.3 83.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.392 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.654 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 5.9 t -64.15 -46.26 84.83 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.462 -179.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.734 HH21 ' CD1' ' A' ' 183' ' ' LEU . 45.5 mtm-85 -66.59 -45.3 79.68 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.285 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -67.08 -43.46 82.51 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.338 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 62.4 m -63.69 -45.01 91.98 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.999 0.428 . . . . 0.0 110.23 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -67.34 -35.07 78.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.998 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.721 HD23 ' HZ1' ' A' ' 193' ' ' LYS . 14.2 mt -61.73 -45.55 93.43 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.083 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 55.9 pttt -80.45 -34.28 36.12 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.582 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 42.7 tt0 -69.24 -42.89 75.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.026 -179.33 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.721 ' HZ1' HD23 ' A' ' 190' ' ' LEU . 10.1 pttm -74.34 -43.2 57.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.3 OUTLIER -68.6 -40.01 80.65 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.873 -179.726 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.491 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 9.2 ptm180 -67.6 -39.62 84.78 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 75.5 p -60.49 -40.79 92.58 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . . . . . . . . . 85.6 mt -64.93 -43.42 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.894 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -62.58 -42.46 99.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.776 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -65.75 -32.29 73.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.081 178.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -63.02 -46.18 94.03 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 201' ' ' LEU . 28.9 mt -63.42 -42.02 98.72 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.028 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.59 -36.58 84.27 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -42.02 98.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.379 178.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.489 HD21 ' OE1' ' A' ' 141' ' ' GLU . 78.7 mt -61.62 -41.55 97.63 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -64.25 -42.48 96.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.024 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.696 ' O ' ' N ' ' A' ' 210' ' ' GLN . 15.4 mmm180 -65.32 -40.9 94.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.981 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.66 ' O ' ' N ' ' A' ' 211' ' ' GLY . 2.2 t -63.77 -45.38 97.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.043 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 77.9 p -67.85 -28.19 67.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.762 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -101.66 -14.67 17.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.61 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.696 ' N ' ' O ' ' A' ' 206' ' ' ARG . 47.6 tt0 -131.59 -28.2 1.86 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.86 0.362 . . . . 0.0 111.107 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.66 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -79.14 25.74 2.62 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.506 ' CE1' ' O ' ' A' ' 127' ' ' SER . 30.7 t80 -60.41 -44.8 95.37 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.747 0.308 . . . . 0.0 110.2 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.483 ' O ' ' OG ' ' A' ' 213' ' ' SER . 0.0 OUTLIER -172.8 18.04 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.03 -179.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 30.9 p -132.54 161.54 33.54 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.743 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -154.62 146.77 23.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.233 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -115.92 172.58 7.06 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.755 0.312 . . . . 0.0 110.946 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -162.44 35.53 0.11 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.652 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.538 ' O ' ' CB ' ' A' ' 219' ' ' GLU . 99.5 m-85 -107.63 140.26 40.91 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.919 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.538 ' CB ' ' O ' ' A' ' 218' ' ' PHE . 8.4 tm-20 92.43 -32.27 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 179.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -60.74 155.59 50.65 Favored Pre-proline 0 N--CA 1.464 0.235 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.203 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 222' ' ' ARG . 31.7 Cg_exo -57.12 119.32 6.51 Favored 'Trans proline' 0 N--CA 1.491 1.373 0 C-N-CA 122.149 1.9 . . . . 0.0 112.051 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 221' ' ' PRO . 63.2 ttm-85 178.63 -93.58 0.0 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.757 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.559 HG11 HD22 ' A' ' 308' ' ' LEU . 0.2 OUTLIER -60.55 -47.16 93.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.733 -179.388 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.429 HD11 ' HE1' ' A' ' 250' ' ' PHE . 1.1 mp -65.41 -26.71 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.836 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -67.45 -46.54 72.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 109.767 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.566 ' O ' ' HB2' ' A' ' 229' ' ' LEU . 5.0 tp -61.14 -41.27 96.43 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.354 179.302 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.469 ' CZ2' HD23 ' A' ' 308' ' ' LEU . 44.2 m0 -60.06 -42.01 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.066 -0.653 . . . . 0.0 109.677 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -65.06 -29.84 70.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' A' ' 226' ' ' LEU . 4.0 mt -62.2 -43.26 99.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.872 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.932 ' O ' HD21 ' A' ' 235' ' ' LEU . . . -36.07 -42.91 0.31 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.919 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -39.53 -34.24 0.21 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.855 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 39.3 m -130.87 66.14 1.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.532 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . 0.936 ' H ' HD11 ' A' ' 235' ' ' LEU . . . -144.2 46.7 1.42 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 58.9 t30 63.17 73.56 0.45 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.494 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.936 HD11 ' H ' ' A' ' 233' ' ' ALA . 0.3 OUTLIER -108.85 -160.32 0.72 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.095 0.474 . . . . 0.0 110.843 179.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.4 ' OG1' ' CD ' ' A' ' 239' ' ' GLU . 0.2 OUTLIER -131.74 -146.97 0.3 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.746 -179.157 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -101.59 -66.17 0.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.814 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.35 -40.9 97.92 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.446 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . 0.502 ' HA ' ' HB3' ' A' ' 322' ' ' GLU . 34.0 mt-10 -61.93 -35.38 78.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.884 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.3 OUTLIER -63.15 -46.04 89.05 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.79 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -65.34 -44.81 86.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.473 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . 0.623 ' HB1' ' CZ ' ' A' ' 319' ' ' ARG . . . -60.27 -41.45 93.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.49 -44.67 93.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.724 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -58.76 -52.98 63.39 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 -178.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -64.96 -36.91 85.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.697 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -61.79 -45.0 95.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.359 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.488 ' O ' ' CB ' ' A' ' 251' ' ' GLU . 1.9 mm? -63.34 -41.23 98.86 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.768 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.74 -39.81 90.08 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.888 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -63.96 -63.04 1.26 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . 0.436 ' CD1' ' C ' ' A' ' 250' ' ' PHE . 29.4 t80 -59.78 -45.23 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 0.0 110.924 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.488 ' CB ' ' O ' ' A' ' 247' ' ' LEU . 53.1 tp10 -55.03 -41.58 71.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.15 80.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -59.92 -45.83 91.34 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.838 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . 0.468 ' CG2' ' O ' ' A' ' 251' ' ' GLU . 1.4 tp -66.84 -42.42 89.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.919 179.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.34 -45.59 92.91 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.713 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -62.73 -41.58 99.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.29 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -43.45 81.04 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -61.58 -40.79 96.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.212 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . 0.513 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 79.7 t60 -58.96 -47.95 83.29 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.212 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -62.29 -37.04 83.97 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.344 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -43.79 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -61.82 -46.92 87.38 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.805 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . 0.513 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 6.0 mp0 -63.39 -36.77 84.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.864 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 50.3 tp -61.66 -42.46 98.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.348 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -63.05 -46.8 85.8 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.084 0.469 . . . . 0.0 110.74 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 59.6 mt -63.02 -42.98 98.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.965 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.81 83.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.084 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -62.18 -44.88 95.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.35 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -59.24 -46.84 87.42 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.048 0.451 . . . . 0.0 110.344 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -60.48 -40.38 91.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.345 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.4 ' CD2' ' OE2' ' A' ' 275' ' ' GLU . 5.4 tt -59.52 -44.11 93.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -59.37 -44.48 92.73 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.995 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -67.63 -42.62 82.04 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.668 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . 0.637 ' O ' HG12 ' A' ' 277' ' ' VAL . . . -60.7 -35.35 76.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.926 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . 0.4 ' OE2' ' CD2' ' A' ' 271' ' ' LEU . 90.7 mt-10 -61.31 -28.83 69.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.843 0.354 . . . . 0.0 110.447 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 97.1 p -89.1 5.91 42.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 274' ' ' ALA . 11.8 p -60.88 -44.2 97.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.702 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.56 ' N ' HG13 ' A' ' 277' ' ' VAL . . . 134.76 -86.67 0.25 Allowed Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -62.93 -39.96 96.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.721 0.296 . . . . 0.0 110.603 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . 0.578 ' O ' ' N ' ' A' ' 282' ' ' ARG . . . 87.91 -106.52 3.22 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 63.16 -53.8 0.19 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.851 0.358 . . . . 0.0 110.568 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . 0.578 ' N ' ' O ' ' A' ' 280' ' ' GLY . 16.4 ptm180 -72.26 -15.42 61.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.509 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 78.8 t -60.61 -44.95 97.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.43 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 11.1 t -59.97 -44.9 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.006 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -61.59 -43.21 99.29 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.025 0.44 . . . . 0.0 110.532 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . . . . . . . . . 5.6 t -60.94 -42.35 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.093 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -61.67 -41.72 97.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.279 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -57.62 -53.74 54.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.262 -0.427 . . . . 0.0 109.895 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.445 ' HD3' HD23 ' A' ' 292' ' ' LEU . 13.1 mmtm -64.62 -34.36 78.09 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.211 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -58.21 -46.41 85.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.058 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -68.78 -40.36 79.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.913 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.699 ' O ' HD12 ' A' ' 292' ' ' LEU . 1.3 tp -62.92 -52.86 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.87 -43.28 99.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.149 0.5 . . . . 0.0 110.232 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.01 -36.54 84.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -61.88 -50.44 65.76 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 110.539 -1.025 . . . . 0.0 110.539 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -59.69 -41.28 90.36 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 5.9 m -59.45 -49.15 78.92 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 120.962 0.41 . . . . 0.0 110.04 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -63.72 -44.29 94.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -57.74 -40.22 79.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.03 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.24 -43.14 99.49 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.855 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -57.95 -43.4 94.93 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -61.88 -44.45 96.79 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.095 0.474 . . . . 0.0 110.778 179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 15.5 m -60.07 -43.7 95.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.206 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.4 -44.24 92.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.924 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.78 -54.66 43.81 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.076 -179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -62.98 -41.69 99.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.46 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.696 ' NE2' HD13 ' A' ' 311' ' ' LEU . 5.3 t-160 -61.68 -39.15 90.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.047 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.559 HD22 HG11 ' A' ' 223' ' ' VAL . 26.0 mt -60.66 -44.55 96.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.439 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . 0.598 ' OE1' ' N ' ' A' ' 309' ' ' GLN . 0.0 OUTLIER -63.12 -49.31 74.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.592 -179.985 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -63.03 -68.88 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.158 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.696 HD13 ' NE2' ' A' ' 307' ' ' HIS . 1.8 tp -41.68 -46.4 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.704 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . . . . . . . . . 56.6 m -60.02 -41.8 92.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.514 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -64.59 -35.96 92.57 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.562 ' O ' HD11 ' A' ' 323' ' ' LEU . 18.1 mmm180 -73.54 -64.69 0.94 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.829 0.314 . . . . 0.0 110.977 -179.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.721 HG22 ' N ' ' A' ' 316' ' ' SER . 0.8 OUTLIER -40.59 -104.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.228 -179.071 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . 0.721 ' N ' HG22 ' A' ' 315' ' ' ILE . 1.0 OUTLIER 62.37 -5.27 0.18 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.608 ' HD2' HD12 ' A' ' 323' ' ' LEU . 0.1 OUTLIER -173.04 -33.71 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.534 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.541 ' N ' ' HD3' ' A' ' 317' ' ' ARG . . . -165.79 -97.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.908 ' O ' HD22 ' A' ' 323' ' ' LEU . 7.7 ptm180 -175.03 156.29 2.13 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . 0.817 ' O ' ' N ' ' A' ' 322' ' ' GLU . 86.4 t60 -25.81 136.98 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 113.863 -1.517 . . . . 0.0 112.955 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.618 ' C ' ' H ' ' A' ' 323' ' ' LEU . 6.8 m120 54.79 -58.99 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.61 0.719 . . . . 0.0 109.099 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.817 ' N ' ' O ' ' A' ' 320' ' ' HIS . 80.2 mm-40 -65.06 36.56 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.283 -1.326 . . . . 0.0 109.909 178.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.908 HD22 ' O ' ' A' ' 319' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.609 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 t -135.16 141.6 45.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.558 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 74.5 ttt-85 -159.05 99.11 1.5 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.667 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -141.12 142.7 34.06 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.843 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -135.04 133.09 39.01 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.637 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -151.1 146.01 25.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.717 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -82.83 138.93 43.2 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.552 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -73.04 154.76 52.76 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.828 2.352 . . . . 0.0 112.4 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.97 160.03 53.21 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.309 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -63.96 147.14 91.98 Favored 'Trans proline' 0 C--N 1.302 -1.883 0 C-N-CA 122.882 2.388 . . . . 0.0 112.327 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.463 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -171.77 -58.91 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.545 -179.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 11' ' ' SER . 29.6 Cg_endo -63.59 -171.18 0.13 Allowed 'Trans proline' 0 N--CA 1.497 1.681 0 C-N-CA 122.447 2.098 . . . . 0.0 112.231 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.535 ' HG2' ' H ' ' A' ' 15' ' ' GLU . 39.6 ttmt -41.86 113.71 0.46 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.519 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -91.9 14.57 15.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.908 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.535 ' H ' ' HG2' ' A' ' 13' ' ' LYS . 81.4 tt0 63.8 150.49 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.3 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.8 -142.47 0.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.242 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.79 21.73 6.63 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -51.1 133.85 27.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.855 0.36 . . . . 0.0 110.577 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -65.74 -37.21 85.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.67 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -108.19 177.83 4.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.922 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -64.48 -36.8 85.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.82 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 99.6 mmm -118.56 148.75 42.33 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.21 0.529 . . . . 0.0 110.788 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.67 -38.12 88.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.694 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.29 -47.59 83.16 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.185 0.517 . . . . 0.0 110.321 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.9 tp -63.14 -38.59 91.78 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.501 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -64.24 -40.02 95.15 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.379 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.7 tp60 -62.81 -42.21 99.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.163 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -62.08 -44.4 96.74 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.016 0.436 . . . . 0.0 109.95 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -60.51 -49.57 77.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.362 0.601 . . . . 0.0 110.385 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -58.22 -38.54 77.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.279 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 tppt? -60.61 -46.06 91.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.179 0.514 . . . . 0.0 110.235 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.46 91.91 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.006 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.586 ' O ' ' CD2' ' A' ' 36' ' ' HIS . 89.2 mt-30 -58.58 -38.64 78.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.194 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.589 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 62.8 ttm-85 -62.47 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.45 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.512 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.589 ' CE1' ' O ' ' A' ' 34' ' ' ARG . 25.9 m80 66.0 113.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.7 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 mt -137.45 154.99 75.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.858 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -43.31 155.1 0.16 Allowed 'Trans proline' 0 C--N 1.311 -1.434 0 C-N-CA 122.657 2.238 . . . . 0.0 112.12 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -65.43 -34.78 42.21 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.648 2.232 . . . . 0.0 112.094 -179.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.41 HG22 ' H ' ' A' ' 40' ' ' VAL . 3.0 m -68.02 -47.94 76.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.673 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.408 ' H ' HG23 ' A' ' 40' ' ' VAL . 96.9 mtt180 -66.87 -40.06 87.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.416 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.28 -44.09 97.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.501 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.58 -45.53 90.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.431 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.7 tp10 -66.72 -42.76 85.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.502 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.88 -49.55 74.38 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.728 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -58.94 -40.54 84.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.053 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.66 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.36 -48.82 80.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.682 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.11 -49.31 72.06 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.539 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.6 mt -58.59 -40.62 83.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.145 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.27 -37.37 80.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.981 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 47' ' ' ALA . 42.9 mm -63.23 -43.44 98.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.792 179.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.4 ' NE2' ' ND2' ' A' ' 80' ' ' ASN . 99.0 mm-40 -57.14 -45.76 83.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.165 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.94 -49.9 76.08 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.263 0.554 . . . . 0.0 110.133 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -59.53 -44.77 93.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.457 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -61.41 -37.54 83.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -58.45 -47.93 82.38 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.007 0.432 . . . . 0.0 109.864 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 57' ' ' LEU . 32.0 mt -60.75 -42.01 96.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.211 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.25 -48.2 82.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.428 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -56.8 -39.28 73.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.253 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm -59.86 -46.64 88.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -60.6 -45.51 93.71 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.471 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.15 -39.55 92.99 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.99 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -58.66 -42.97 89.66 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.735 ' O ' HD13 ' A' ' 64' ' ' LEU . 0.3 OUTLIER -60.58 -42.64 97.09 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.68 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -69.5 -21.47 63.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.202 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 85.23 14.58 68.61 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.1 -43.5 95.17 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.959 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -78.33 141.13 38.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.541 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -148.58 -46.93 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.627 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -65.76 -32.22 73.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.641 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.23 13.09 69.21 Favored Glycine 0 CA--C 1.527 0.832 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.56 -38.94 86.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.755 0.312 . . . . 0.0 110.332 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.599 ' HA ' ' HE ' ' A' ' 76' ' ' ARG . 55.4 mttp -56.78 -57.57 11.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.004 0.43 . . . . 0.0 110.154 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -53.2 -39.14 63.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.183 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.85 -40.25 92.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.272 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.599 ' HE ' ' HA ' ' A' ' 73' ' ' LYS . 88.0 mtm180 -63.35 -39.26 94.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.58 -44.5 93.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -47.24 89.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.381 0.61 . . . . 0.0 110.224 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.615 ' O ' HG23 ' A' ' 83' ' ' VAL . 2.9 ttt180 -61.44 -41.93 97.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.119 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.49 ' O ' HG13 ' A' ' 84' ' ' ILE . 38.6 t30 -61.25 -41.03 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.257 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.688 ' O ' HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -59.75 -48.69 80.68 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.191 0.52 . . . . 0.0 110.06 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -66.75 -39.13 87.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.578 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 79' ' ' ARG . 54.2 t -63.52 -45.98 96.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.411 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 80' ' ' ASN . 96.7 mt -60.43 -49.01 86.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.354 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.73 -42.82 85.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.965 0.412 . . . . 0.0 111.069 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.62 -45.82 92.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.549 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.66 -47.46 83.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.602 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.83 -22.35 66.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.128 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 77.15 19.81 76.48 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 90' ' ' LEU . 43.8 mt -89.09 -1.07 57.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.816 0.341 . . . . 0.0 110.422 179.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -82.44 57.11 3.53 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.047 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -83.66 -161.5 31.94 Favored Glycine 0 CA--C 1.523 0.556 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.096 -178.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 94' ' ' LYS . 98.8 mttt 62.79 -177.8 0.14 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.371 -0.415 . . . . 0.0 110.37 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 93' ' ' LYS . 48.5 tptt 54.87 114.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.227 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.651 ' C ' ' H ' ' A' ' 97' ' ' ARG . 94.7 m-20 50.08 -165.67 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.876 179.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 95' ' ' ASP . . . 65.59 -21.35 0.09 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.311 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.651 ' H ' ' C ' ' A' ' 95' ' ' ASP . 60.0 ttt85 -65.55 -42.63 91.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.885 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.46 ' O ' ' O ' ' A' ' 97' ' ' ARG . 86.7 mt-30 46.77 99.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.131 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 63.4 t -61.91 -45.16 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.277 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 57.7 p -133.49 158.57 42.77 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.483 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.6 m -176.59 -48.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.726 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.484 ' OD1' ' O ' ' A' ' 102' ' ' ASN . 40.3 p30 -75.32 140.97 43.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.588 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.5 m -134.93 57.48 1.81 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.632 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.624 ' C ' ' H ' ' A' ' 106' ' ' GLY . 88.8 mt -97.92 15.59 23.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.797 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.39 -19.94 0.09 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.614 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.624 ' H ' ' C ' ' A' ' 104' ' ' LEU . . . 47.7 94.29 0.01 OUTLIER Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.7 m -121.73 126.13 48.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.756 0.312 . . . . 0.0 110.611 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.444 ' O ' ' O ' ' A' ' 109' ' ' GLU . 72.5 tp60 -150.43 149.97 30.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.319 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.444 ' O ' ' O ' ' A' ' 108' ' ' GLN . 83.6 tt0 59.52 135.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.488 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 109' ' ' GLU . 97.5 m-20 -140.37 124.34 17.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.548 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -101.6 -70.65 0.89 Allowed Glycine 0 CA--C 1.522 0.516 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.508 ' O ' ' OE2' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -139.58 -171.05 3.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.774 0.321 . . . . 0.0 110.71 -179.853 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.602 ' CG ' ' H ' ' A' ' 114' ' ' ASP . 21.6 p30 -98.25 -78.49 0.49 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.918 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.602 ' H ' ' CG ' ' A' ' 113' ' ' ASP . 21.5 m-20 -48.97 114.08 3.52 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.49 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.77 -35.02 56.97 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.539 2.159 . . . . 0.0 112.219 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -58.52 -45.27 89.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.687 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.2 mt -69.14 -36.07 77.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.005 0.431 . . . . 0.0 110.727 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 122' ' ' HIS . 93.8 mt-10 -61.05 -34.65 75.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.619 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 123' ' ' LYS . 71.3 mmtt -59.91 -44.07 94.48 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.468 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.12 -44.44 72.39 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.885 0.374 . . . . 0.0 111.69 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.6 ' CZ3' HD22 ' A' ' 135' ' ' LEU . 16.4 t-105 -61.57 -46.69 88.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.847 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.573 ' CD2' ' O ' ' A' ' 118' ' ' GLU . 11.5 m-70 -68.57 -37.61 80.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.768 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 127' ' ' SER . 0.7 OUTLIER -57.31 -51.92 67.42 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.898 -178.543 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.438 ' HB1' ' HB2' ' A' ' 130' ' ' PHE . . . -73.32 -45.99 52.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.999 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.501 ' HB2' HD11 ' A' ' 135' ' ' LEU . 62.1 tttm -48.54 -44.19 36.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.84 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.8 m -108.62 -63.46 1.34 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.907 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -54.89 -11.73 0.68 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.598 -178.725 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.56 ' O ' ' CD1' ' A' ' 130' ' ' PHE . . . -131.76 -3.09 4.19 Favored Glycine 0 CA--C 1.519 0.301 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' SER . 46.5 mttp 54.69 8.71 0.23 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.223 0.535 . . . . 0.0 109.848 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.56 ' CD1' ' O ' ' A' ' 128' ' ' GLY . 14.2 m-30 -67.82 51.19 0.06 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.821 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.553 ' HA ' HD12 ' A' ' 135' ' ' LEU . 96.8 p -97.63 112.29 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.762 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.403 ' H ' ' HB2' ' A' ' 135' ' ' LEU . . . 122.94 -97.93 0.59 Allowed Glycine 0 CA--C 1.528 0.871 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.299 178.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 137' ' ' LYS . 79.7 mm-40 -77.74 -44.01 29.11 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.042 -179.135 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 134' ' ' GLU . 56.4 mp0 -65.6 -43.87 88.35 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.529 -0.469 . . . . 0.0 109.9 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.6 HD22 ' CZ3' ' A' ' 121' ' ' TRP . 0.6 OUTLIER -62.04 -41.4 98.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.886 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -63.67 -36.93 85.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.945 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 133' ' ' GLU . 97.2 mttt -63.0 -44.1 96.95 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.418 0.628 . . . . 0.0 110.057 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.02 -42.55 94.59 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -66.07 -37.83 86.79 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.619 -0.718 . . . . 0.0 112.687 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.547 ' O ' ' CG ' ' A' ' 144' ' ' HIS . 0.6 OUTLIER -51.85 -41.64 62.0 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.483 ' N ' ' OE1' ' A' ' 141' ' ' GLU . 0.7 OUTLIER -70.22 -42.42 72.32 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.539 178.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -59.41 -52.85 63.86 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.209 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.539 ' CD2' ' N ' ' A' ' 143' ' ' LEU . 2.5 mm? -61.96 -40.64 96.26 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.307 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.547 ' CG ' ' O ' ' A' ' 140' ' ' ARG . 45.2 m170 -53.55 -44.99 69.69 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.474 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.573 ' CE1' HG23 ' A' ' 197' ' ' ILE . 3.4 m-70 -63.83 -41.63 97.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.572 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.6 mmmt -60.27 -41.47 93.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.159 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . 0.472 ' HA ' ' ND1' ' A' ' 150' ' ' HIS . 50.5 mt-10 -70.2 -55.49 9.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.558 -179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -63.52 -44.21 94.93 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.406 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.523 ' CG1' ' N ' ' A' ' 150' ' ' HIS . 2.8 p -60.83 -44.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.438 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.696 ' C ' ' CD2' ' A' ' 150' ' ' HIS . 1.2 p-80 -66.15 -33.71 76.4 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.324 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.609 ' N ' ' CD2' ' A' ' 150' ' ' HIS . 91.7 mt-10 -63.33 -39.94 95.94 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.313 -0.555 . . . . 0.0 109.892 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -61.93 -49.4 76.32 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.084 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -68.64 -43.78 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 19.3 t -60.75 -45.07 98.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.096 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.4 mt -63.21 -45.71 90.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.539 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.409 ' O ' ' OG ' ' A' ' 160' ' ' SER . 19.9 mt -65.29 -42.51 93.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.752 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -68.8 -31.09 69.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.193 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 66.1 m -68.98 -48.06 64.07 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.97 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 160' ' ' SER . 4.3 pp -78.97 -36.96 40.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.821 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.808 ' N ' HD12 ' A' ' 159' ' ' LEU . 67.3 m -59.47 -45.59 91.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.867 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 70.3 mtp180 -73.37 -46.73 47.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.206 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' THR . . . . . 0.619 HG22 ' N ' ' A' ' 163' ' ' GLU . 87.5 m -80.38 164.95 22.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.781 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.619 ' N ' HG22 ' A' ' 162' ' ' THR . 78.6 tt0 65.05 -1.24 0.9 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.14 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.478 ' H ' ' C ' ' A' ' 162' ' ' THR . 88.4 mt-10 -149.01 23.31 0.96 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.46 179.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' ILE . . . . . 0.555 HG23 ' O ' ' A' ' 165' ' ' ILE . 9.9 tp -57.0 123.25 7.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.365 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 165' ' ' ILE . 44.0 m80 -155.41 25.58 0.41 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.355 0.597 . . . . 0.0 109.601 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.431 ' O ' ' O ' ' A' ' 168' ' ' ASN . 81.4 tt0 53.14 73.75 0.34 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.946 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.431 ' O ' ' O ' ' A' ' 167' ' ' GLU . 97.3 m-20 59.52 126.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.843 179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 56.8 t -130.2 133.73 63.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.472 ' O ' HG23 ' A' ' 170' ' ' ILE . 20.7 tt -131.36 128.47 61.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.596 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' SER . . . . . . . . . . . . . 18.3 m -160.31 85.86 1.96 Allowed Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 120.75 0.31 . . . . 0.0 110.177 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -41.08 95.51 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 C-N-CA 122.684 2.256 . . . . 0.0 111.971 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 14.8 t -140.11 140.76 36.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.656 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -59.5 -46.8 87.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.308 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.655 HD22 ' CD2' ' A' ' 187' ' ' HIS . 84.0 mt -134.3 107.06 7.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.169 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 1.3 m 44.93 -85.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.188 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' ASP . . . . . 0.611 ' N ' ' O ' ' A' ' 175' ' ' LEU . 66.4 t0 -173.95 44.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.681 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.638 ' O ' ' N ' ' A' ' 180' ' ' GLY . 1.1 pp -139.21 39.74 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.582 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 63.8 mttm 59.28 -65.8 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.578 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.638 ' N ' ' O ' ' A' ' 178' ' ' ILE . . . 157.5 53.91 0.01 OUTLIER Glycine 0 CA--C 1.524 0.601 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 83.1 p -121.7 -4.26 9.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.752 0.311 . . . . 0.0 110.735 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.808 HG12 ' H ' ' A' ' 183' ' ' LEU . 11.9 t -142.31 178.14 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.614 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.808 ' H ' HG12 ' A' ' 182' ' ' VAL . 82.3 mt 60.08 3.82 0.56 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.872 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.465 ' ND1' ' N ' ' A' ' 185' ' ' SER . 1.9 p80 -58.54 -43.27 89.22 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.667 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.465 ' N ' ' ND1' ' A' ' 184' ' ' HIS . 36.2 t -62.36 -44.97 95.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.276 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.509 HH22 HD22 ' A' ' 159' ' ' LEU . 43.0 ttt85 -60.99 -45.06 96.3 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.994 0.426 . . . . 0.0 110.937 -179.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 187' ' ' HIS . . . . . 0.655 ' CD2' HD22 ' A' ' 175' ' ' LEU . 58.9 m-70 -63.99 -35.04 79.4 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.022 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 188' ' ' THR . . . . . . . . . . . . . 51.7 m -61.35 -42.65 99.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.734 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.97 -38.14 89.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.591 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 187' ' ' HIS . 0.8 OUTLIER -60.98 -45.25 95.55 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.718 179.367 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 63.3 mttp -70.15 -36.1 74.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 192' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 195' ' ' ARG . 2.9 tm-20 -68.06 -47.9 67.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.059 0.457 . . . . 0.0 111.741 -178.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.469 ' HG2' ' N ' ' A' ' 194' ' ' LEU . 15.8 pttt -73.13 -41.61 63.78 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.416 -179.219 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.757 HD12 ' C ' ' A' ' 194' ' ' LEU . 0.4 OUTLIER -68.67 -41.11 79.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.063 -179.59 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 195' ' ' ARG . . . . . 0.535 ' N ' ' HG ' ' A' ' 194' ' ' LEU . 36.1 ptt180 -67.57 -39.12 84.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 196' ' ' SER . . . . . . . . . . . . . 67.4 m -58.64 -42.38 88.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 197' ' ' ILE . . . . . 0.573 HG23 ' CE1' ' A' ' 145' ' ' HIS . 91.2 mt -64.14 -43.64 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.429 178.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -61.1 -40.92 95.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.415 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 199' ' ' GLN . . . . . 0.504 ' O ' ' OD2' ' A' ' 202' ' ' ASP . 94.7 mt-30 -60.51 -40.31 90.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.52 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -61.6 -41.48 99.58 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 197' ' ' ILE . 1.4 mm? -63.24 -41.17 99.04 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.155 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . 0.551 ' C ' ' OD1' ' A' ' 202' ' ' ASP . 0.2 OUTLIER -62.61 -37.39 86.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.41 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 203' ' ' ARG . . . . . 0.459 ' N ' ' OD1' ' A' ' 202' ' ' ASP . 8.0 tmm_? -61.46 -43.85 98.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.731 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 32.1 mt -61.67 -40.26 94.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -64.85 -42.04 95.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.126 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.744 ' O ' ' N ' ' A' ' 210' ' ' GLN . 99.6 mtt180 -61.43 -45.33 94.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.366 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 207' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 211' ' ' GLY . 39.8 t -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.296 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.564 ' O ' ' CG ' ' A' ' 212' ' ' TYR . 89.3 p -61.89 -37.33 84.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.543 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 209' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -94.33 -43.09 8.57 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.102 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 210' ' ' GLN . . . . . 0.744 ' N ' ' O ' ' A' ' 206' ' ' ARG . 58.6 tt0 -87.05 -42.92 12.7 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 211' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 207' ' ' VAL . . . -71.98 14.28 2.21 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . 0.564 ' CG ' ' O ' ' A' ' 208' ' ' SER . 2.5 m-85 -103.77 146.72 28.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.126 0.489 . . . . 0.0 111.31 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 36.5 t -62.0 143.98 55.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.83 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 214' ' ' THR . . . . . . . . . . . . . 48.9 p -111.32 -164.6 0.93 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.702 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 63.2 157.95 0.07 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.598 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -92.6 169.38 10.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.286 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.5 ' OE1' ' N ' ' A' ' 217' ' ' GLU . 57.0 mp0 -139.45 34.57 2.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 218' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' A' ' 219' ' ' GLU . 45.7 p90 -62.48 -48.54 79.13 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 120.755 0.312 . . . . 0.0 110.406 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 220' ' ' GLU . 11.3 tm-20 -110.86 -78.72 0.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.115 0.483 . . . . 0.0 110.292 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 220' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 219' ' ' GLU . 0.0 OUTLIER 54.78 169.91 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.988 -179.878 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.557 ' O ' ' CB ' ' A' ' 222' ' ' ARG . 41.4 Cg_exo -55.85 150.86 43.57 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.461 2.107 . . . . 0.0 112.025 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 222' ' ' ARG . . . . . 0.715 ' O ' ' N ' ' A' ' 225' ' ' ASP . 24.1 ttp180 87.51 -139.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.493 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 223' ' ' VAL . . . . . 0.527 HG23 ' H ' ' A' ' 224' ' ' ILE . 2.5 m 27.77 -104.17 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.207 0.527 . . . . 0.0 110.72 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.527 ' H ' HG23 ' A' ' 223' ' ' VAL . 1.3 mp -59.78 -39.05 78.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.787 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 225' ' ' ASP . . . . . 0.715 ' N ' ' O ' ' A' ' 222' ' ' ARG . 55.9 m-20 -62.53 -40.66 97.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 6.8 tp -60.0 -43.56 95.11 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.338 0.59 . . . . 0.0 109.491 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 227' ' ' TRP . . . . . 0.433 ' O ' ' HB3' ' A' ' 230' ' ' ALA . 26.0 m0 -63.14 -33.95 76.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.695 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 228' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -61.42 -38.95 88.98 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.513 ' O ' ' N ' ' A' ' 232' ' ' SER . 97.8 mt -63.44 -42.1 98.66 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.787 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 230' ' ' ALA . . . . . 0.498 ' C ' ' O ' ' A' ' 229' ' ' LEU . . . -28.3 -44.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.955 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 231' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 229' ' ' LEU . 8.7 tt0 -67.33 -53.56 28.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.719 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 229' ' ' LEU . 30.2 t -68.61 -18.1 64.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.5 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 233' ' ' ALA . . . . . . . . . . . . . . . -69.02 -82.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.657 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 234' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -177.6 98.81 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.631 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 235' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 235' ' ' LEU . 53.4 mt -145.09 151.62 38.79 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 68.1 p -79.62 169.25 18.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.691 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 237' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -61.38 -48.24 82.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.829 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -60.28 -49.29 78.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.99 0.424 . . . . 0.0 110.817 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 239' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.24 -37.52 85.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.675 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.78 -40.57 95.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.43 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 241' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.95 -55.6 31.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.612 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 242' ' ' ALA . . . . . . . . . . . . . . . -59.39 -37.13 77.19 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.776 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 243' ' ' PHE . . . . . 0.583 ' O ' HD23 ' A' ' 247' ' ' LEU . 0.4 OUTLIER -63.33 -45.92 89.02 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.938 178.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 244' ' ' ARG . . . . . 0.445 ' N ' ' CD1' ' A' ' 243' ' ' PHE . 45.0 ttm180 -60.91 -45.02 96.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.071 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 245' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -65.93 -46.56 77.78 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 51.8 tp10 -59.67 -47.42 85.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.253 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.583 HD23 ' O ' ' A' ' 243' ' ' PHE . 2.4 mm? -63.73 -39.39 94.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.798 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 248' ' ' LYS . . . . . 0.401 ' O ' ' CG ' ' A' ' 251' ' ' GLU . 86.5 tttt -54.81 -48.1 73.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.165 0.507 . . . . 0.0 110.115 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -67.74 -37.96 82.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 250' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -61.05 -49.56 76.88 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.833 0.349 . . . . 0.0 111.066 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 251' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 247' ' ' LEU . 16.1 pt-20 -62.41 -35.4 79.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.894 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.98 -39.11 92.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.386 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.29 -50.78 68.76 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.978 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 254' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -30.36 49.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.176 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -64.54 -46.39 83.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 110.172 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 256' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -62.89 -44.45 96.06 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.349 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 257' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -57.61 -42.99 84.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.253 179.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -61.15 -40.79 95.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.133 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 259' ' ' HIS . . . . . 0.533 ' O ' ' OE1' ' A' ' 263' ' ' GLN . 81.9 t60 -59.43 -47.08 86.86 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.27 0.557 . . . . 0.0 110.279 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 260' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -62.44 -36.23 81.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.371 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 261' ' ' GLN . . . . . 0.676 HE21 ' CG2' ' A' ' 297' ' ' THR . 83.2 mm-40 -61.71 -42.37 98.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.214 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 262' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -60.62 -47.66 85.21 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 263' ' ' GLN . . . . . 0.533 ' OE1' ' O ' ' A' ' 259' ' ' HIS . 3.7 mp0 -65.78 -37.67 86.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.166 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 264' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.73 -43.5 98.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.248 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -62.81 -48.93 76.99 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.13 0.49 . . . . 0.0 110.424 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 70.3 mt -62.3 -43.0 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.901 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 267' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.54 76.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 268' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -63.88 -49.29 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.279 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 269' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.75 -44.03 82.53 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.037 0.446 . . . . 0.0 110.672 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 270' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -62.39 -45.75 91.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.572 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.54 HD13 ' CB ' ' A' ' 286' ' ' SER . 42.8 tp -62.05 -42.46 99.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.785 0.326 . . . . 0.0 110.344 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 272' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -57.25 -42.8 82.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.277 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 273' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -80.14 -26.92 39.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.528 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 274' ' ' ALA . . . . . . . . . . . . . . . -63.55 -38.14 90.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.735 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 275' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -53.73 -20.91 6.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.548 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 276' ' ' SER . . . . . . . . . . . . . 73.5 m -62.37 -37.18 84.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.73 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 277' ' ' VAL . . . . . . . . . . . . . 73.0 t -61.01 -45.22 98.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.49 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 98.74 17.78 27.24 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 279' ' ' ASP . . . . . 0.424 ' O ' HG23 ' A' ' 283' ' ' VAL . 99.8 m-20 -82.5 106.63 14.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.823 0.344 . . . . 0.0 110.462 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 280' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.21 91.8 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 281' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -61.63 -53.93 49.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.769 0.319 . . . . 0.0 110.632 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -68.2 -43.88 77.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.778 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 283' ' ' VAL . . . . . 0.577 ' CG1' ' NH1' ' A' ' 287' ' ' ARG . 41.8 t -61.85 -48.28 89.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.701 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 284' ' ' SER . . . . . . . . . . . . . 42.9 t -62.99 -46.04 89.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.777 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 285' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -63.25 -41.33 99.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.788 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 286' ' ' SER . . . . . 0.54 ' CB ' HD13 ' A' ' 271' ' ' LEU . 55.4 m -59.64 -45.3 92.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.398 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 287' ' ' ARG . . . . . 0.577 ' NH1' ' CG1' ' A' ' 283' ' ' VAL . 59.6 mtt85 -64.03 -38.16 90.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.975 0.417 . . . . 0.0 110.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 288' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -57.76 -60.98 2.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.393 0.616 . . . . 0.0 110.238 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 289' ' ' LYS . . . . . 0.513 ' HD3' HD23 ' A' ' 292' ' ' LEU . 4.9 mmtp -63.34 -40.46 97.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.043 178.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 290' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -42.62 -52.49 4.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.182 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 291' ' ' ALA . . . . . . . . . . . . . . . -69.09 -37.63 78.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.677 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 292' ' ' LEU . . . . . 0.513 HD23 ' HD3' ' A' ' 289' ' ' LYS . 22.8 tp -61.41 -52.28 65.24 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.587 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 293' ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.83 -42.05 97.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.251 0.548 . . . . 0.0 109.991 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . 0.502 ' O ' ' OG1' ' A' ' 297' ' ' THR . 82.3 tt0 -62.25 -35.34 78.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.695 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -64.47 -44.81 94.69 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 296' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -59.58 -43.48 93.63 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.09 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . 0.676 ' CG2' HE21 ' A' ' 261' ' ' GLN . 36.0 p -60.5 -42.19 95.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.243 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 298' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -63.73 -45.12 91.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.434 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -60.92 -44.15 97.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.305 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 300' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -42.74 99.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.962 0.411 . . . . 0.0 110.429 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 301' ' ' GLY . . . . . . . . . . . . . . . -58.28 -43.23 95.66 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 302' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -62.15 -42.86 99.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.399 . . . . 0.0 110.449 178.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 303' ' ' THR . . . . . . . . . . . . . 10.5 m -61.25 -44.96 96.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.482 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 304' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.56 -43.27 90.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.972 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 305' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -59.33 -49.6 77.2 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.626 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 306' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -62.9 -43.56 98.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.341 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 307' ' ' HIS . . . . . 0.538 ' O ' ' CB ' ' A' ' 311' ' ' LEU . 0.1 OUTLIER -63.58 -37.05 85.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.138 179.321 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 308' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 312' ' ' SER . 11.8 mt -61.34 -41.87 97.75 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.436 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 309' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -68.52 -58.84 3.71 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.05 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 310' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.11 -48.79 78.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.265 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 311' ' ' LEU . . . . . 0.561 HD12 ' NH2' ' A' ' 314' ' ' ARG . 12.4 tp -61.0 -42.78 99.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.703 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 312' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 308' ' ' LEU . 67.2 p -61.67 -36.11 79.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.519 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 313' ' ' GLY . . . . . . . . . . . . . . . -66.26 -44.96 89.69 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 314' ' ' ARG . . . . . 0.561 ' NH2' HD12 ' A' ' 311' ' ' LEU . 87.0 mtm180 -63.2 -43.46 98.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.738 0.304 . . . . 0.0 110.855 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.442 ' O ' HG22 ' A' ' 315' ' ' ILE . 2.1 mm -74.09 -15.79 16.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.692 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 316' ' ' SER . . . . . . . . . . . . . 6.1 t -53.49 -48.65 68.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.262 0.553 . . . . 0.0 109.726 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.688 ' C ' ' H ' ' A' ' 319' ' ' ARG . 19.9 ptp180 -109.2 -26.2 10.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.76 -176.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 317' ' ' ARG . . . 70.03 -30.53 0.2 Allowed 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 119.116 -1.033 . . . . 0.0 109.407 -178.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 319' ' ' ARG . . . . . 0.688 ' H ' ' C ' ' A' ' 317' ' ' ARG . 6.3 tpt180 66.18 161.69 0.15 Allowed 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -177.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 320' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -65.22 -40.86 94.66 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.101 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 321' ' ' ASN . . . . . 0.597 ' O ' ' N ' ' A' ' 323' ' ' LEU . 64.1 t30 -117.83 158.93 23.92 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 122.205 -0.309 . . . . 0.0 110.569 177.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 322' ' ' GLU . . . . . 0.464 ' O ' ' C ' ' A' ' 323' ' ' LEU . 81.3 tt0 -35.16 88.68 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 O-C-N 122.014 -0.429 . . . . 0.0 110.868 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 323' ' ' LEU . . . . . 0.831 HD22 ' H ' ' A' ' 323' ' ' LEU . 3.6 mm? . . . . . 0 C--N 1.317 -0.821 0 CA-C-O 118.072 -0.966 . . . . 0.0 111.412 -179.86 . . . . . . . . 1 1 . 1 stop_ save_